data_1ozs_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 1ozs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.832 0.349 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' B' ' 138' ' ' PHE . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.456 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.463 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.4 ' HG2' ' O ' ' A' ' 117' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.417 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.427 ' CE1' HD22 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.429 ' N ' HD23 ' A' ' 154' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.417 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.439 ' CE2' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.666 0.269 . . . . 0.0 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.439 HD12 ' CE2' ' B' ' 132' ' ' PHE . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.427 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 6.3 m-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.809 0.337 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.408 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.415 HD12 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.408 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.425 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.408 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.42 ' HB2' ' CD2' ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.405 HG23 HD12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.478 HD11 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.478 ' O ' HD11 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.448 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.44 ' N ' HD13 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.448 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' B' ' 138' ' ' PHE . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.443 HD12 ' CE2' ' B' ' 132' ' ' PHE . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.416 ' HB2' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.414 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' B' ' 138' ' ' PHE . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.444 ' CD2' HG22 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.578 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.459 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.438 ' HA ' HD11 ' A' ' 119' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.444 HG22 ' CD2' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.438 ' HE1' ' CE2' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.42 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.401 ' CG2' ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.428 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.438 ' O ' ' CD1' ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.435 ' CD1' HD22 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.413 ' CB ' HD13 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.435 HD22 ' CD1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.459 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' B' ' 138' ' ' PHE . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.448 ' CE2' ' CD1' ' B' ' 134' ' ' LEU . 27.2 p90 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.664 0.269 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.448 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.421 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.851 0.358 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.468 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.424 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.507 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.427 ' HB3' ' CG2' ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HA ' HD21 ' A' ' 121' ' ' LEU . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 118' ' ' LYS . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.424 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.507 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.44 ' HA ' ' CE1' ' A' ' 101' ' ' PHE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.442 ' CB ' HG12 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.468 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.438 HD21 ' CD2' ' A' ' 153' ' ' PHE . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.456 ' CE ' ' CE2' ' B' ' 138' ' ' PHE . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.406 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.412 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 111.071 0.026 . . . . 0.0 111.071 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.477 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.467 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.467 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 157' ' ' MET . 5.3 m-85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.759 0.314 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.426 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.505 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 120' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.438 ' HB2' ' CD2' ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.42 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.406 HG22 ' CD2' ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.4 m-20 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.505 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.443 ' O ' HD11 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.418 ' CE1' HD23 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.426 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.408 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.409 ' HG3' ' N ' ' A' ' 158' ' ' LYS . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.403 ' HA ' ' CG ' ' B' ' 135' ' ' ARG . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.444 ' CE2' HD11 ' B' ' 134' ' ' LEU . 32.6 p90 . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 120.805 0.335 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.444 HD11 ' CE2' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.546 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.546 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.814 0.34 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.444 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.568 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.418 ' HA ' HD13 ' A' ' 119' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.432 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.441 HG23 HD12 ' A' ' 133' ' ' ILE . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.568 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 151' ' ' ASP . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.462 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.402 ' HG2' ' CD2' ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.4 ' CG2' ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.495 ' CD2' HD11 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.495 HD11 ' CD2' ' B' ' 132' ' ' PHE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.4 ' HA ' ' CG2' ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.411 ' CE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.856 0.36 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.438 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.409 ' N ' HD11 ' A' ' 100' ' ' LEU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.425 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.437 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.47 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.433 ' CB ' HG13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.404 ' CG2' ' CB ' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.514 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.404 ' N ' HG12 ' A' ' 128' ' ' ILE . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.514 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.421 HD11 ' CD2' ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.47 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.422 ' HB3' ' CD1' ' A' ' 111' ' ' TYR . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.454 ' CE1' HD23 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.445 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.454 HD23 ' CE1' ' A' ' 150' ' ' TYR . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.431 ' CE ' ' CE2' ' B' ' 138' ' ' PHE . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.479 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 119.97 -0.062 . . . . 0.0 111.074 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . 0.404 ' CB ' ' CG2' ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.499 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.431 ' CE2' ' CE ' ' A' ' 157' ' ' MET . 1.5 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.795 0.331 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.475 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.441 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.441 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.431 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' CE2' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.454 ' O ' ' CG2' ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.454 ' CG2' ' O ' ' A' ' 126' ' ' GLU . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.404 ' CG2' ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.438 HG21 HD12 ' A' ' 133' ' ' ILE . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.472 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' A' ' 151' ' ' ASP . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.445 ' CE1' HD22 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 97' ' ' LEU . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.427 ' HG3' HD23 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 157' ' ' MET . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.505 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.505 HD13 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.838 0.352 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.46 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.473 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 120' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.436 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 104' ' ' PHE . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' CZ ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.406 HG22 ' CD2' ' B' ' 132' ' ' PHE . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.423 HD13 ' N ' ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.423 ' N ' HD13 ' A' ' 128' ' ' ILE . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.434 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . 0.422 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.471 ' HB2' ' CE2' ' A' ' 111' ' ' TYR . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.473 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.46 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.439 HD22 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.47 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.434 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.491 HG11 ' CG ' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 110.799 -0.074 . . . . 0.0 110.799 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.491 ' CG ' HG11 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.849 0.357 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.441 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.411 ' CE1' ' HE1' ' A' ' 120' ' ' MET . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.552 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.438 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.409 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.411 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.449 ' CG2' ' CD1' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.402 ' CD1' ' CB ' ' A' ' 132' ' ' ASP . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.438 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.443 ' HA ' HD11 ' A' ' 136' ' ' LEU . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.419 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.552 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.42 ' O ' ' N ' ' A' ' 151' ' ' ASP . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.47 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.441 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.415 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.411 ' HB3' ' CD1' ' B' ' 138' ' ' PHE . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.491 ' CE2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.491 HD12 ' CE2' ' B' ' 132' ' ' PHE . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.411 ' CD1' ' HB3' ' A' ' 157' ' ' MET . 9.3 m-85 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.412 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.439 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.414 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.47 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.403 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.439 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.434 ' CD1' HG12 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.414 ' HB2' ' CD1' ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.483 ' O ' HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.419 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 133' ' ' ILE . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.447 ' O ' HD12 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.418 ' HG3' ' N ' ' A' ' 158' ' ' LYS . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.421 HG22 ' HA ' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.419 ' CZ ' ' OD2' ' A' ' 132' ' ' ASP . 41.6 p90 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.601 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.702 0.287 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.404 HD11 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.407 ' CZ ' HG23 ' A' ' 119' ' ' ILE . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.407 HG23 ' CZ ' ' A' ' 104' ' ' PHE . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.409 ' CD2' ' CG2' ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.409 ' CG2' ' CD2' ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.45 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.451 ' HB2' ' CE2' ' A' ' 101' ' ' PHE . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.449 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.434 HD22 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.45 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.458 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.41 ' N ' ' CD1' ' B' ' 134' ' ' LEU . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' A' ' 100' ' ' LEU . 12.2 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.828 0.347 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.403 ' CD1' HD21 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.463 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.475 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.438 ' CG2' ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.438 ' CB ' ' CG2' ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 129' ' ' THR . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.424 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.463 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.425 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.424 ' CE1' HD22 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.429 ' CA ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.424 HD22 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.424 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 110.677 -0.12 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.462 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.821 0.344 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.464 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.445 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.437 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.463 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.402 ' HB3' ' CG2' ' A' ' 112' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.46 ' O ' ' HG2' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.417 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.42 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.472 HG12 ' CB ' ' A' ' 152' ' ' GLU . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 151' ' ' ASP . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.472 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.464 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.418 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.417 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.421 ' HG3' HD23 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.913 -0.032 . . . . 0.0 110.913 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' B' ' 138' ' ' PHE . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.435 HD12 ' CE2' ' B' ' 132' ' ' PHE . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.414 ' CE1' ' O ' ' B' ' 133' ' ' ASP . 92.1 m-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 120.582 0.23 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.462 HD13 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 112' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.443 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.414 ' CD2' ' HB ' ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.414 ' HB ' ' CD2' ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.427 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.446 ' O ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.438 ' HB2' ' CE2' ' A' ' 101' ' ' PHE . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.473 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.445 ' HG3' ' CE2' ' B' ' 138' ' ' PHE . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.421 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.461 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.456 ' CD2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-O 120.207 0.051 . . . . 0.0 111.005 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.456 HD11 ' CD2' ' B' ' 132' ' ' PHE . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.461 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.462 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.816 0.341 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.46 HD23 ' CE1' ' B' ' 138' ' ' PHE . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.493 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.401 HD23 ' CG1' ' A' ' 128' ' ' ILE . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.425 ' O ' HG13 ' A' ' 128' ' ' ILE . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 127' ' ' THR . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.437 ' HA ' HG13 ' A' ' 133' ' ' ILE . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.478 HD12 HG22 ' A' ' 133' ' ' ILE . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . 0.436 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.425 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.506 HD11 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.506 ' O ' HD11 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.49 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.436 HD23 ' CB ' ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.409 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 110.669 -0.123 . . . . 0.0 110.669 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.468 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.409 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' HD23 ' A' ' 100' ' ' LEU . 71.5 m-85 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.75 0.309 . . . . 0.0 110.964 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' B' ' 138' ' ' PHE . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.499 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.405 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.41 ' HB3' ' HB3' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.405 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.424 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.597 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.448 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.499 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.424 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' B' ' 135' ' ' ARG . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.478 ' CE2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.478 HD13 ' CE2' ' B' ' 132' ' ' PHE . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.605 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.605 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 100' ' ' LEU . 6.3 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.456 HD21 ' CE ' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 105' ' ' ASP . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.513 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.463 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.402 HD11 HG21 ' A' ' 133' ' ' ILE . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.425 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.513 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.42 ' O ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.439 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.506 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.439 HD21 ' CE1' ' A' ' 150' ' ' TYR . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.46 ' CE ' ' CE1' ' B' ' 138' ' ' PHE . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.411 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.445 ' O ' ' CD1' ' B' ' 134' ' ' LEU . 3.5 p90 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.685 0.279 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.445 ' CD1' ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.411 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.401 ' CD1' ' HG2' ' A' ' 157' ' ' MET . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.42 HD12 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.427 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.502 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.408 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.443 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.431 HD12 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.431 ' CG2' HD12 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.404 ' HA ' ' CD1' ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.408 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.502 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.452 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.427 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.452 HD21 ' CE1' ' A' ' 150' ' ' TYR . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.401 ' HG2' ' CD1' ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.496 ' CD2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.496 HD12 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.42 ' CE1' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.842 0.353 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.407 ' CZ ' ' HE3' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.51 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.423 ' O ' HD11 ' A' ' 119' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.423 HD11 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.407 ' HE3' ' CZ ' ' A' ' 104' ' ' PHE . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.407 ' OD2' ' CE1' ' B' ' 132' ' ' PHE . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.413 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.51 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 151' ' ' ASP . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.436 ' CB ' HG12 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.429 ' N ' ' CD1' ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.413 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.408 ' HA ' ' HG3' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.498 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.7 OUTLIER . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 119.945 -0.074 . . . . 0.0 111.04 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.433 HD12 ' CE2' ' B' ' 132' ' ' PHE . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.804 0.335 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.408 ' CD1' HD23 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' B' ' 138' ' ' PHE . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.561 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.455 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . 0.41 ' CB ' ' CB ' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.476 ' CG2' ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 150' ' ' TYR . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.476 ' CD1' ' CG2' ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . 0.419 ' O ' ' CZ ' ' B' ' 138' ' ' PHE . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.466 HD12 ' CE1' ' B' ' 132' ' ' PHE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.78 0.324 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.417 ' CD2' ' HE3' ' A' ' 120' ' ' MET . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.461 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.417 ' HE3' ' CD2' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.448 HG23 ' CD1' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.495 ' O ' HD12 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.513 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.445 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 157' ' ' MET . . . . . 0.435 ' HG3' HD23 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.448 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.423 HD22 ' CD1' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.42 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.85 0.357 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.444 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.512 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.461 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 137' ' ' MET . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.418 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.431 HG23 ' CD2' ' B' ' 132' ' ' PHE . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' MET . . . . . 0.412 ' HB2' ' CD1' ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . 0.409 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.512 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.493 ' O ' HD12 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.431 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.44 ' HB2' HD12 ' A' ' 148' ' ' ILE . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.444 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.42 HD23 ' CE1' ' A' ' 150' ' ' TYR . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.406 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.42 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.46 ' CE2' HD11 ' B' ' 134' ' ' LEU . 34.8 p90 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.42 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.778 0.323 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.415 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.479 ' CZ ' ' HE3' ' A' ' 120' ' ' MET . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.479 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.479 ' HE3' ' CZ ' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.402 ' O ' HG21 ' A' ' 124' ' ' THR . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.415 HG23 ' N ' ' A' ' 125' ' ' GLY . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.415 ' N ' HG23 ' A' ' 124' ' ' THR . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 126' ' ' GLU . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.411 ' CG2' ' HB3' ' A' ' 117' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.426 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.411 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.479 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' A' ' 151' ' ' ASP . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . 0.47 ' CB ' HG12 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.442 ' HA ' HD12 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . 0.434 ' CG2' ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.572 ' CD1' HD13 ' B' ' 134' ' ' LEU . 16.8 p90 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 119.901 -0.095 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.572 HD13 ' CD1' ' B' ' 132' ' ' PHE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . 0.434 ' HA ' ' CG2' ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' A' ' 100' ' ' LEU . 32.8 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.776 0.322 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.469 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.457 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.44 ' CZ ' ' CE ' ' A' ' 120' ' ' MET . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.488 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' A' ' 120' ' ' MET . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.409 HG22 ' N ' ' A' ' 125' ' ' GLY . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . 0.409 ' N ' HG22 ' A' ' 124' ' ' THR . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.43 HG23 HD13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.431 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.488 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' HD11 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.469 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.43 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.446 ' CE2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.431 0.157 . . . . 0.0 110.919 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.446 HD12 ' CE2' ' B' ' 132' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.4 ' CD1' HD23 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.419 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.415 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.446 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.507 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.403 ' HB3' ' CG2' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.446 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 127' ' ' THR . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.404 ' HA ' HD22 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.42 ' CD1' HG12 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.4 ' HB3' ' CD1' ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.42 HG12 ' CD1' ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.412 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.414 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.507 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.47 ' O ' HD12 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' A' ' 98' ' ' SER . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.447 ' CA ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' A' ' 150' ' ' TYR . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.412 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.405 ' O ' ' CD2' ' B' ' 132' ' ' PHE . 43.9 p90 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.781 0.324 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CE1' HD21 ' A' ' 100' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.773 0.32 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.472 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.418 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.439 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.462 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.481 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HD2' ' O ' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.439 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.434 ' O ' ' CG2' ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.447 HG23 HG12 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.447 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.431 HG22 HD13 ' A' ' 133' ' ' ILE . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.444 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.481 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.437 ' O ' HD11 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.423 ' CD1' HD22 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.472 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 154' ' ' LEU . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.444 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 111.408 0.151 . . . . 0.0 111.408 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.4 ' CD1' HD23 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.474 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.438 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . 0.435 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.474 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.44 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.469 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.431 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 150' ' ' TYR . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . 0.467 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.515 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.5 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.039 -0.029 . . . . 0.0 110.961 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.508 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.839 0.352 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.427 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.42 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.502 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.434 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.413 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.402 HG23 ' CE2' ' B' ' 132' ' ' PHE . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.444 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.502 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.501 ' O ' HD11 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.482 ' CE2' ' CD2' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.462 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.421 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.402 ' CE2' HG23 ' A' ' 124' ' ' THR . 34.4 p90 . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 120.735 0.302 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.497 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.41 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' HA ' ' A' ' 129' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 129' ' ' THR . . . . . 0.403 ' HA ' ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.459 HG22 HD11 ' A' ' 133' ' ' ILE . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.497 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 150' ' ' TYR . . . . . 0.44 ' CE1' ' CD2' ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . 0.429 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.468 ' HA ' HD21 ' A' ' 154' ' ' LEU . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 132' ' ' PHE . . . . . 0.497 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 134' ' ' LEU . . . . . 0.407 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.809 0.338 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -83.28 161.3 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.871 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -142.86 163.26 27.35 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.501 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -84.85 106.57 16.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 -45.8 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.417 HD11 ' CE1' ' B' ' 138' ' ' PHE . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.456 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.463 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.4 ' HG2' ' O ' ' A' ' 117' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.417 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.427 ' CE1' HD22 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.429 ' N ' HD23 ' A' ' 154' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.417 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 23.7 p . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . 0.431 ' O ' ' CB ' ' B' ' 130' ' ' LYS . 4.3 mt-30 -136.49 -75.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' B' ' 129' ' ' GLN . 1.3 mtmm 84.04 -30.8 0.08 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 15.0 mm -86.74 133.93 28.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.857 0.36 . . . . 0.0 111.092 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.439 ' CE2' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 -175.66 98.35 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.956 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.439 HD12 ' CE2' ' B' ' 132' ' ' PHE . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.427 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 6.3 m-85 -134.72 29.86 3.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -103.41 -50.27 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.768 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.13 146.4 5.38 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -83.05 113.2 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.435 2.09 . . . . 0.0 112.419 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 2.8 t -115.89 138.87 50.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.3 111.25 8.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -95.92 114.81 26.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.955 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -76.68 138.36 39.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.8 -45.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.157 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.438 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 5.4 tpp180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.144 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.895 0.378 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -125.08 -50.14 1.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.51 -151.82 9.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.516 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -131.47 88.59 2.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.23 172.9 14.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.791 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.408 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.415 HD12 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.408 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.425 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.408 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.42 ' HB2' ' CD2' ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.405 HG23 HD12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.478 HD11 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.478 ' O ' HD11 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.448 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.44 ' N ' HD13 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.448 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' B' ' 138' ' ' PHE . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.826 0.346 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -139.05 31.29 2.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 mtmt 60.64 101.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.991 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.456 ' CD1' ' N ' ' B' ' 131' ' ' ILE . 0.0 OUTLIER -144.72 165.94 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.937 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.467 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -144.81 -98.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.594 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.443 HD12 ' CE2' ' B' ' 132' ' ' PHE . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.416 ' HB2' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER -134.08 30.32 3.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm -112.03 -61.44 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.12 137.25 12.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.967 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -88.91 134.8 2.7 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.582 2.188 . . . . 0.0 112.577 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.05 178.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 76.7 mt 61.63 -81.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 61.96 121.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.934 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 63.2 165.64 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.85 -45.5 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.123 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.443 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.171 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.775 0.322 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt 61.24 112.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -140.6 -81.98 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.57 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -27.2 7.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.671 0.272 . . . . 0.0 111.155 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t -94.96 -63.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.414 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' B' ' 138' ' ' PHE . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.444 ' CD2' HG22 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.578 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.459 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.438 ' HA ' HD11 ' A' ' 119' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.444 HG22 ' CD2' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.438 ' HE1' ' CE2' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.42 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.401 ' CG2' ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.428 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.438 ' O ' ' CD1' ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.435 ' CD1' HD22 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.413 ' CB ' HD13 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.462 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.435 HD22 ' CD1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.459 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' B' ' 138' ' ' PHE . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.791 0.329 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -110.6 -30.43 7.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.051 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 39.5 mmtt -109.22 84.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.039 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 13.2 mm -87.66 147.12 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.739 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.448 ' CE2' ' CD1' ' B' ' 134' ' ' LEU . 27.2 p90 -176.91 106.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.106 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.448 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.421 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 -131.24 27.28 4.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.25 -179.1 5.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.007 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -137.3 139.88 29.15 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.892 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.82 104.47 0.42 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.812 2.341 . . . . 0.0 112.53 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 8.6 m -92.84 -57.33 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.72 112.1 16.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.71 100.04 2.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 39.9 ptt85 -99.51 151.2 21.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.13 154.78 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.482 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.872 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 14.5 ptm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.871 0.367 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -155.97 148.81 24.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -97.57 70.36 0.72 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.541 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -73.05 155.45 39.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -159.67 -45.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.468 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.424 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.507 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.427 ' HB3' ' CG2' ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.41 ' HA ' HD21 ' A' ' 121' ' ' LEU . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.424 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 118' ' ' LYS . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.424 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.507 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.44 ' HA ' ' CE1' ' A' ' 101' ' ' PHE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.442 ' CB ' HG12 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.468 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.438 HD21 ' CD2' ' A' ' 153' ' ' PHE . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.406 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.456 ' CE ' ' CE2' ' B' ' 138' ' ' PHE . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.406 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.412 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.852 0.358 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -125.45 103.03 7.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.891 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt 68.12 -63.12 0.34 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.186 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.417 ' CG2' ' HB2' ' B' ' 134' ' ' LEU . 0.1 OUTLIER -112.21 172.64 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 0.0 110.972 179.856 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.2 OUTLIER -147.16 -107.78 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.071 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.477 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.467 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.467 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 157' ' ' MET . 5.3 m-85 -69.06 64.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.404 ' CG ' ' CG1' ' A' ' 160' ' ' VAL . 8.0 mttt -123.24 -76.79 0.59 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -147.53 139.85 14.27 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.92 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -56.84 122.94 12.7 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.468 2.112 . . . . 0.0 112.224 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.2 p -131.75 -51.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 14.1 mt -145.61 125.3 13.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.67 -53.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -157.31 153.01 26.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.446 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.7 p -43.03 -45.24 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.348 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.446 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 14.6 mmm180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.06 97.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.61 50.0 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.538 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -140.69 -54.87 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.369 . . . . 0.0 110.902 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m -91.17 -27.94 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.426 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.416 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.505 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.424 ' O ' ' HG2' ' A' ' 120' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.438 ' HB2' ' CD2' ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.42 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.406 HG22 ' CD2' ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.4 m-20 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.505 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.443 ' O ' HD11 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.418 ' CE1' HD23 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.426 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.408 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.409 ' HG3' ' N ' ' A' ' 158' ' ' LYS . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.409 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.417 HG12 ' CG ' ' B' ' 139' ' ' LYS . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.3 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.802 0.334 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -163.71 40.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.965 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.415 ' O ' ' CE1' ' B' ' 132' ' ' PHE . 0.2 OUTLIER 70.01 -63.39 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.078 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.454 ' CG2' ' HB2' ' B' ' 135' ' ' ARG . 12.8 mm -78.4 152.2 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.173 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.444 ' CE2' HD11 ' B' ' 134' ' ' LEU . 32.6 p90 178.34 109.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.217 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.444 HD11 ' CE2' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.546 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.546 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -72.98 58.81 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.417 ' CG ' HG12 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -168.5 -169.92 1.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.669 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.94 154.13 64.22 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.914 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -84.58 -175.47 2.14 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.586 2.191 . . . . 0.0 112.512 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.5 123.76 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 39.1 mt 60.15 159.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.17 155.23 41.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 62.79 39.0 11.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -70.96 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.286 -179.732 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.814 0.34 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm 60.29 179.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -160.73 95.24 0.14 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.547 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.57 -174.89 5.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.28 -59.98 1.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.867 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.514 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.444 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.411 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.568 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.418 ' HA ' HD13 ' A' ' 119' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.432 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.441 HG23 HD12 ' A' ' 133' ' ' ILE . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.568 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 151' ' ' ASP . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.462 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.454 ' HA ' HD12 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.402 ' HG2' ' CD2' ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.4 ' CG2' ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.804 0.335 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.39 126.02 53.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 4.6 tppt? -138.41 142.86 39.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.966 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.503 HG21 ' HB2' ' B' ' 134' ' ' LEU . 3.7 mm -65.75 154.75 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.827 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.495 ' CD2' HD11 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -112.39 -112.77 0.33 Allowed 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.739 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.503 ' HB2' HG21 ' B' ' 131' ' ' ILE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.4 ' HA ' ' CG2' ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.411 ' CE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 -137.38 30.34 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -127.54 -58.65 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.923 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.37 156.98 35.15 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.028 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.44 117.71 3.46 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.423 2.082 . . . . 0.0 112.351 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 6.0 t -95.76 133.27 40.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.2 mp -141.13 158.48 43.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.93 30.95 4.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.78 98.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.866 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.8 -29.96 3.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.51 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 23.8 mtt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.841 -179.981 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.807 0.337 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.63 166.7 22.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 113.26 27.13 3.76 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.546 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -132.88 126.92 33.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.809 0.338 . . . . 0.0 110.856 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t 62.09 151.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.438 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.409 ' N ' HD11 ' A' ' 100' ' ' LEU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.425 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.437 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.47 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.433 ' CB ' HG13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.404 ' CG2' ' CB ' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.514 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.404 ' N ' HG12 ' A' ' 128' ' ' ILE . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.514 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.421 HD11 ' CD2' ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.47 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.422 ' HB3' ' CD1' ' A' ' 111' ' ' TYR . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.454 ' CE1' HD23 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.445 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.454 HD23 ' CE1' ' A' ' 150' ' ' TYR . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.431 ' CE ' ' CE2' ' B' ' 138' ' ' PHE . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.406 HG11 ' CG ' ' B' ' 139' ' ' LYS . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.756 0.312 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.2 117.4 8.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.894 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -129.54 -50.14 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.421 ' CG2' ' HB2' ' B' ' 135' ' ' ARG . 4.8 mm -59.25 154.86 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.999 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -133.29 -110.16 0.23 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.074 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . 0.404 ' CB ' ' CG2' ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.499 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.499 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.431 ' CE2' ' CE ' ' A' ' 157' ' ' MET . 1.5 m-85 -73.15 57.4 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.406 ' CG ' HG11 ' A' ' 160' ' ' VAL . 14.8 mttt -118.49 -31.85 4.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.922 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 157.44 39.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.794 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -76.68 89.89 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.359 2.04 . . . . 0.0 112.394 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 4.0 p -149.62 100.33 2.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.864 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 33.5 mt -111.66 -33.77 6.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -95.01 44.52 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -141.25 120.35 12.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.63 157.88 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.538 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.3 mtm-85 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.885 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 30.8 mtt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.818 0.342 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -117.92 -173.86 2.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -159.79 135.55 4.17 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -136.21 -65.47 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.869 0.366 . . . . 0.0 110.922 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -64.91 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.475 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.424 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.441 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.441 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.431 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' CE2' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.454 ' O ' ' CG2' ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.454 ' CG2' ' O ' ' A' ' 126' ' ' GLU . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.404 ' CG2' ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.438 HG21 HD12 ' A' ' 133' ' ' ILE . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.472 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' A' ' 151' ' ' ASP . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.445 ' CE1' HD22 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.475 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.473 ' HA ' HD23 ' A' ' 97' ' ' LEU . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.427 ' HG3' HD23 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 157' ' ' MET . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.806 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -154.12 147.18 24.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.49 164.73 11.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.52 HG21 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -72.65 154.3 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.858 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.505 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -114.58 -109.68 0.36 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.624 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.52 ' HB2' HG21 ' B' ' 131' ' ' ILE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -128.88 29.01 5.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -113.4 -44.5 3.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.81 156.42 29.8 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.966 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.16 -43.63 0.14 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.455 2.103 . . . . 0.0 112.44 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 9.1 t -138.05 177.16 8.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.31 -52.93 59.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.827 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 21.4 ttp85 63.47 124.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -123.89 133.4 53.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.39 -35.07 8.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.481 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.845 0.355 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.22 81.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.38 135.85 13.65 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.5 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.63 31.56 21.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m -122.47 32.0 5.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.46 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.473 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 120' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.436 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.424 ' HE2' ' CZ ' ' A' ' 104' ' ' PHE . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' CZ ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.406 HG22 ' CD2' ' B' ' 132' ' ' PHE . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.423 HD13 ' N ' ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.423 ' N ' HD13 ' A' ' 128' ' ' ILE . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.434 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . 0.422 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.471 ' HB2' ' CE2' ' A' ' 111' ' ' TYR . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.473 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.46 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.439 HD22 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.47 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.434 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.491 HG11 ' CG ' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 60.87 111.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -101.74 -44.42 5.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 7.8 mm -87.55 140.48 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.022 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -144.03 -112.89 0.1 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.799 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.491 ' CG ' HG11 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.417 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -44.78 -27.84 0.56 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.463 ' HB3' ' CG1' ' A' ' 160' ' ' VAL . 0.0 OUTLIER -92.26 -177.27 4.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.938 0.399 . . . . 0.0 111.01 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -158.2 127.73 3.23 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.587 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 31.6 Cg_exo -59.17 -165.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.538 2.159 . . . . 0.0 112.401 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 8.2 m -158.41 31.23 0.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.836 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.2 mt 61.27 161.65 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.824 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.85 -67.59 0.21 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.994 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -118.82 102.19 8.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.941 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -50.35 -35.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.4 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.927 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.6 mtm . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.811 0.338 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -148.65 -59.59 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 153.53 147.83 4.74 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.78 30.36 19.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p -84.39 -36.18 22.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.441 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.411 ' CE1' ' HE1' ' A' ' 120' ' ' MET . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.552 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.438 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.409 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.411 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.449 ' CG2' ' CD1' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.402 ' CD1' ' CB ' ' A' ' 132' ' ' ASP . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.438 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.443 ' HA ' HD11 ' A' ' 136' ' ' LEU . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.419 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.552 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.42 ' O ' ' N ' ' A' ' 151' ' ' ASP . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.47 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.441 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.415 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.411 ' HB3' ' CD1' ' B' ' 138' ' ' PHE . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.815 0.34 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 63.01 143.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.38 -51.74 9.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.804 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.541 HG21 ' HB2' ' B' ' 134' ' ' LEU . 3.9 mm -59.61 155.06 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.852 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.491 ' CE2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -116.66 -111.52 0.35 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.534 -179.742 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.541 ' HB2' HG21 ' B' ' 131' ' ' ILE . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.411 ' CD1' ' HB3' ' A' ' 157' ' ' MET . 9.3 m-85 -133.62 -45.12 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.6 100.24 4.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.42 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.1 OUTLIER -74.03 126.95 88.85 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 23.6 Cg_exo -64.05 -65.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.511 2.141 . . . . 0.0 112.224 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.24 -176.31 5.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mp -87.09 135.4 33.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.893 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -128.22 153.36 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 60.04 178.54 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.473 ' CG1' ' O ' ' B' ' 146' ' ' VAL . 0.3 OUTLIER 49.3 23.91 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.949 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.84 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -155.27 120.59 4.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -84.99 0.14 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.608 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt 62.1 147.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m 59.58 161.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.412 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.439 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.414 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.47 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.403 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.439 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.434 ' CD1' HG12 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.414 ' HB2' ' CD1' ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.483 ' O ' HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.419 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.463 HD11 HG21 ' A' ' 133' ' ' ILE . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 148' ' ' ILE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.447 ' O ' HD12 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.469 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.418 ' HG3' ' N ' ' A' ' 158' ' ' LYS . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.418 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.421 HG22 ' HA ' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.786 0.327 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -153.2 84.72 1.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.979 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -58.34 -23.63 57.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.935 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.417 ' CG2' ' N ' ' B' ' 132' ' ' PHE . 8.2 mm -80.7 157.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.649 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.419 ' CZ ' ' OD2' ' A' ' 132' ' ' ASP . 41.6 p90 -179.56 121.71 0.07 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.512 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.601 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.601 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.05 59.0 0.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.41 ' CG ' HG11 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -159.35 -175.73 5.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.865 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.22 165.95 27.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.21 129.14 12.77 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.609 2.206 . . . . 0.0 112.184 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 34.1 p -132.02 -79.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.41 -49.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.862 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.24 -68.52 0.17 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.6 mtm-85 -82.29 101.33 10.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.799 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -140.97 -170.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.845 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.943 179.843 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -77.62 122.23 25.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.925 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 95.93 -156.16 21.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.51 -79.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -102.29 17.74 22.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.203 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.404 HD11 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.407 ' CZ ' HG23 ' A' ' 119' ' ' ILE . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.407 HG23 ' CZ ' ' A' ' 104' ' ' PHE . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.409 ' CD2' ' CG2' ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.409 ' CG2' ' CD2' ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.45 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.451 ' HB2' ' CE2' ' A' ' 101' ' ' PHE . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.449 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.434 HD22 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.45 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.862 0.363 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -175.56 104.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -89.21 -31.35 17.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.066 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 8.4 mm -97.24 137.47 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 111.559 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.458 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -146.74 -110.17 0.09 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.195 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.41 ' N ' ' CD1' ' B' ' 134' ' ' LEU . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' A' ' 100' ' ' LEU . 12.2 m-85 -144.02 36.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.01 141.53 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.959 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.07 156.83 9.57 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.161 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.48 113.91 2.94 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.529 2.153 . . . . 0.0 112.457 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.02 35.94 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.3 98.9 8.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.96 -40.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.48 153.08 44.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.75 -32.13 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.458 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 ptt-85 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.891 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.3 tpp . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.855 0.359 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.99 172.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -137.93 74.09 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.524 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 177.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.748 0.309 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.34 -68.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.952 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.403 ' CD1' HD21 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.463 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.475 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.438 ' CG2' ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.438 ' CB ' ' CG2' ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 129' ' ' THR . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.424 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.463 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.425 ' HB2' ' CD1' ' A' ' 111' ' ' TYR . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.424 ' CE1' HD22 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.429 ' CA ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.424 HD22 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.424 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.876 0.37 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.0 -57.25 0.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -121.7 128.27 51.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 58.37 163.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -141.39 -116.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.462 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -145.08 31.05 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -116.21 158.51 23.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.96 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.07 168.48 9.16 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -67.84 173.71 8.76 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.549 2.166 . . . . 0.0 112.214 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 11.9 p 55.33 102.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.118 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.3 mt -107.95 105.23 14.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 14.4 mtt85 60.61 90.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -165.78 -44.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 54.28 173.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.336 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.862 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.788 0.328 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.05 131.84 1.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.856 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.63 -65.91 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -167.94 37.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.968 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m -74.22 -47.65 34.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.464 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.445 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.437 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.463 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.402 ' HB3' ' CG2' ' A' ' 112' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.46 ' O ' ' HG2' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.417 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.42 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.472 HG12 ' CB ' ' A' ' 152' ' ' GLU . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 151' ' ' ASP . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.472 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.464 ' CZ ' HD21 ' A' ' 97' ' ' LEU . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.418 ' HA ' ' CD1' ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.417 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.421 ' HG3' HD23 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.417 ' CG1' ' HG2' ' B' ' 139' ' ' LYS . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.792 0.33 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -126.88 28.64 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.941 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt 59.02 34.85 23.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 9.3 mm -94.24 135.02 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.906 0.384 . . . . 0.0 111.215 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -150.33 -110.09 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.913 179.382 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . 0.414 ' O ' ' CE1' ' B' ' 138' ' ' PHE . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.435 HD12 ' CE2' ' B' ' 132' ' ' PHE . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.414 ' CE1' ' O ' ' B' ' 133' ' ' ASP . 92.1 m-85 -134.54 28.4 3.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.417 ' HG2' ' CG1' ' A' ' 160' ' ' VAL . 0.1 OUTLIER -154.64 127.6 8.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.729 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.69 139.87 2.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.045 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -85.65 80.67 1.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.586 2.191 . . . . 0.0 112.423 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.09 142.78 51.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 27.9 mt -146.82 -47.33 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -128.53 146.29 50.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -129.25 128.97 44.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.62 164.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.44 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.89 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.777 0.323 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -61.16 -34.7 75.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.33 -126.57 2.12 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 mptt 60.26 103.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.824 0.345 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.97 9.61 7.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.431 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.462 HD13 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.41 ' CD1' HD13 ' A' ' 112' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.443 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.414 ' CD2' ' HB ' ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.414 ' HB ' ' CD2' ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.427 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.446 ' O ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.438 ' HB2' ' CE2' ' A' ' 101' ' ' PHE . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.473 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.445 ' HG3' ' CE2' ' B' ' 138' ' ' PHE . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.421 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.461 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.788 0.328 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.32 38.19 10.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.42 ' O ' ' CE1' ' B' ' 132' ' ' PHE . 8.1 mtmm -114.65 -41.95 3.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mm -100.44 148.47 6.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.456 ' CD2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -153.03 -97.91 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 179.437 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.456 HD11 ' CD2' ' B' ' 132' ' ' PHE . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.461 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.462 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -41.01 -34.86 0.46 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -86.0 148.08 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.26 132.73 6.81 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.726 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -57.16 -162.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.491 2.127 . . . . 0.0 112.29 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -95.7 -50.24 5.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.988 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.39 141.97 45.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -109.73 159.75 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 60.54 170.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.81 -48.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.825 0.345 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.25 83.41 6.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 136.78 102.67 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.549 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -161.07 118.84 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.827 0.346 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m -176.84 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.453 HD23 ' HG2' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.46 HD23 ' CE1' ' B' ' 138' ' ' PHE . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.493 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.401 HD23 ' CG1' ' A' ' 128' ' ' ILE . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.425 ' O ' HG13 ' A' ' 128' ' ' ILE . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 127' ' ' THR . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.437 ' HA ' HG13 ' A' ' 133' ' ' ILE . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.478 HD12 HG22 ' A' ' 133' ' ' ILE . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . 0.436 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.425 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.506 HD11 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.506 ' O ' HD11 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.49 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.436 HD23 ' CB ' ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD23 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.409 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.793 0.33 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -60.29 118.63 6.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -165.08 -43.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.61 140.08 16.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.073 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -143.37 -111.67 0.11 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.669 179.662 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.468 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.409 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' HD23 ' A' ' 100' ' ' LEU . 71.5 m-85 -146.24 30.6 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -95.81 -43.75 7.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.934 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.8 153.14 42.27 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.72 -34.11 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 5.2 m 63.68 140.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.895 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.44 164.12 15.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.955 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -144.94 31.36 1.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -72.89 -70.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.78 131.46 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.423 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.906 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.886 0.374 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.6 109.32 15.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.1 139.09 3.51 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.475 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.53 75.73 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.807 0.336 . . . . 0.0 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 67.71 -71.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 153' ' ' PHE . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.426 HD23 ' CZ ' ' B' ' 138' ' ' PHE . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.499 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.405 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.41 ' HB3' ' HB3' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.597 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.405 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.424 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . 0.417 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.597 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.448 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.499 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.424 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' B' ' 135' ' ' ARG . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.811 0.338 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -102.91 124.65 48.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 18.7 mtmm -146.21 -47.7 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.742 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.485 HG23 ' N ' ' B' ' 132' ' ' PHE . 3.8 mm -71.09 154.38 7.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.761 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.485 ' N ' HG23 ' B' ' 131' ' ' ILE . 0.2 OUTLIER -110.62 -114.3 0.31 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.0 -179.431 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.479 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.605 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.605 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.426 ' CZ ' HD23 ' A' ' 100' ' ' LEU . 6.3 m-85 -72.07 61.25 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.411 ' HG2' ' CG1' ' A' ' 160' ' ' VAL . 0.5 OUTLIER -122.39 172.6 8.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.153 -179.406 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.401 ' HB2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -58.94 159.37 13.72 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.915 179.903 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.401 ' HD2' ' HB2' ' B' ' 140' ' ' ARG . 89.3 Cg_endo -79.52 -38.12 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.282 1.988 . . . . 0.0 112.506 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.0 m -105.01 149.38 25.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.962 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.8 mt -103.93 -32.66 9.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 62.62 -80.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.051 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.4 ptt85 -88.64 105.23 17.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.21 142.19 3.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.399 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.7 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.788 0.328 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -129.9 -52.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -150.89 -173.12 20.62 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.494 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -112.44 80.02 1.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.819 0.342 . . . . 0.0 110.864 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t -171.89 -47.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.873 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.456 HD21 ' CE ' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.434 ' CG ' ' O ' ' A' ' 105' ' ' ASP . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.513 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.463 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.402 HD11 HG21 ' A' ' 133' ' ' ILE . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.425 HD13 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.513 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.42 ' O ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.439 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.506 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.439 HD21 ' CE1' ' A' ' 150' ' ' TYR . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.425 ' CZ ' HD13 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.46 ' CE ' ' CE1' ' B' ' 138' ' ' PHE . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.411 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.832 0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -101.43 -79.39 0.51 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.407 ' HB2' HD12 ' B' ' 131' ' ' ILE . 0.7 OUTLIER -119.11 -33.8 4.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.074 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.437 HG23 ' HB2' ' B' ' 134' ' ' LEU . 0.1 OUTLIER -117.12 170.89 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 120.983 0.421 . . . . 0.0 111.246 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.445 ' O ' ' CD1' ' B' ' 134' ' ' LEU . 3.5 p90 -166.43 105.01 0.63 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.445 ' CD1' ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.411 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 -45.76 -54.74 7.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -28.45 67.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 63.42 135.32 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.921 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -57.92 -163.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.494 2.129 . . . . 0.0 112.295 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 74.4 p -103.95 171.2 7.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.918 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -106.31 133.82 50.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 172.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 29.6 mtt-85 -155.1 95.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.9 149.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.482 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.5 mtt . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.836 0.35 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -93.1 89.97 6.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.871 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.64 104.51 0.22 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp -76.71 113.67 14.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t -166.74 -47.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.401 ' CD1' ' HG2' ' A' ' 157' ' ' MET . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.42 HD12 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.427 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.502 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.408 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.443 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.431 HD12 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.431 ' CG2' HD12 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.404 ' HA ' ' CD1' ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.408 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.502 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.452 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.427 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.452 HD21 ' CE1' ' A' ' 150' ' ' TYR . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.401 ' HG2' ' CD1' ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.3 p . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.94 119.71 39.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.911 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 24.4 mtmt 60.51 -178.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.977 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.523 HG22 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -56.77 154.61 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.496 ' CD2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -115.71 -109.18 0.36 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.534 -179.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.523 ' HB2' HG22 ' B' ' 131' ' ' ILE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.42 ' CE1' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -56.25 -30.84 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.01 176.08 5.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.942 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.82 132.84 0.57 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.751 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -56.77 143.26 91.03 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.463 2.108 . . . . 0.0 112.342 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -93.45 125.63 38.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.6 mt -141.74 179.78 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.86 83.46 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -156.98 -44.94 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -46.53 -29.41 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.6 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.983 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.864 0.364 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.54 147.36 39.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.903 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.78 157.07 7.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.52 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -70.29 135.4 48.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.847 0.356 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.2 t -176.6 -48.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.435 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.407 ' CZ ' ' HE3' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.51 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.423 ' O ' HD11 ' A' ' 119' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.423 HD11 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.407 ' HE3' ' CZ ' ' A' ' 104' ' ' PHE . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.407 ' OD2' ' CE1' ' B' ' 132' ' ' PHE . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.413 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.51 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 151' ' ' ASP . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.436 ' CB ' HG12 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.429 ' N ' ' CD1' ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.413 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.408 ' HA ' ' HG3' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.798 0.333 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -157.61 161.48 38.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -94.16 150.37 20.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 57.57 165.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -146.68 -117.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.04 -179.626 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.433 HD12 ' CE2' ' B' ' 132' ' ' PHE . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.73 26.54 7.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -99.73 -61.22 1.4 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.964 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.434 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 7.8 tpt180 -155.54 131.78 5.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 14.8 Cg_exo -68.49 -167.14 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.49 2.127 . . . . 0.0 112.25 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.65 163.17 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.086 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 29.4 mt -113.42 -36.36 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.85 98.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 48.7 mtt85 58.98 32.33 22.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . 0.416 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.6 t 60.9 156.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.909 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.416 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 10.2 ttm180 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.815 0.341 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.32 113.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.83 131.47 1.91 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.525 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.26 31.57 20.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.29 -44.56 0.93 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.408 ' CD1' HD23 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' B' ' 138' ' ' PHE . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.561 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.455 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . 0.41 ' CB ' ' CB ' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.476 ' CG2' ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.468 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.459 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 150' ' ' TYR . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -110.97 -29.7 7.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.972 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.18 135.86 36.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.514 HG23 ' N ' ' B' ' 132' ' ' PHE . 4.0 mm -69.31 150.16 10.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.667 179.82 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.514 ' N ' HG23 ' B' ' 131' ' ' ILE . 0.3 OUTLIER -117.31 -108.28 0.37 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.744 -179.416 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . 0.419 ' O ' ' CZ ' ' B' ' 138' ' ' PHE . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.466 HD12 ' CE1' ' B' ' 132' ' ' PHE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.415 ' HB2' HG22 ' B' ' 131' ' ' ILE . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 -44.31 -30.28 0.79 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' B' ' 136' ' ' GLY . 0.0 OUTLIER -97.18 150.92 20.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.896 179.829 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.9 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -88.2 106.02 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.775 2.317 . . . . 0.0 112.502 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 32.2 p -68.18 -172.58 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.1 mp -130.05 178.58 6.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.835 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.85 103.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 60.67 81.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.33 -170.22 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.934 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 ptm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.865 0.364 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -123.92 147.2 47.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.92 110.58 3.57 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.498 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 30.92 3.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.44 -43.78 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.417 ' CD2' ' HE3' ' A' ' 120' ' ' MET . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.44 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.461 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.417 ' HE3' ' CD2' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.448 HG23 ' CD1' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.495 ' O ' HD12 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.513 ' CD2' ' CD1' ' A' ' 101' ' ' PHE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.445 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 157' ' ' MET . . . . . 0.435 ' HG3' HD23 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.77 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -152.18 116.45 4.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.16 88.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.403 ' CG2' ' N ' ' B' ' 132' ' ' PHE . 0.0 OUTLIER 53.86 175.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.335 179.866 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.448 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.0 OUTLIER -143.91 -144.94 0.16 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.791 -179.876 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.423 HD22 ' CD1' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.42 ' HG2' ' H ' ' B' ' 136' ' ' GLY . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . 0.42 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 -118.36 21.99 12.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.9 155.94 40.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.673 179.887 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.94 132.88 0.28 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.745 179.967 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -88.56 -21.38 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.827 2.351 . . . . 0.0 112.915 -179.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.38 -69.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.999 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -138.94 177.76 7.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -167.79 113.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 43.44 67.16 0.68 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.465 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -47.21 -29.17 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.54 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.941 179.995 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 17.5 ttt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.876 0.37 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -130.12 88.67 2.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.45 85.14 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.492 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.28 100.12 5.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 110.913 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m -149.26 -53.72 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.444 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.512 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.461 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 137' ' ' MET . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.418 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.431 HG23 ' CD2' ' B' ' 132' ' ' PHE . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.412 ' HB2' ' CD1' ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . 0.409 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.512 ' O ' ' HA ' ' A' ' 111' ' ' TYR . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.493 ' O ' HD12 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.431 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.44 ' HB2' HD12 ' A' ' 148' ' ' ILE . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.444 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.42 HD23 ' CE1' ' A' ' 150' ' ' TYR . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.406 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.42 ' CG2' ' HG3' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.788 0.328 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.14 -49.67 4.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.932 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.482 ' O ' ' O ' ' B' ' 131' ' ' ILE . 0.0 OUTLIER 61.42 -175.73 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.954 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.482 ' O ' ' O ' ' B' ' 130' ' ' LYS . 14.3 mm 54.01 141.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 179.225 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.46 ' CE2' HD11 ' B' ' 134' ' ' LEU . 34.8 p90 177.85 112.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.968 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.42 ' HG3' ' CG2' ' A' ' 160' ' ' VAL . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 -140.34 36.4 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -113.38 -37.17 4.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.088 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 157.19 72.94 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.009 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.51 135.39 9.25 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.507 2.138 . . . . 0.0 112.434 -180.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 t -73.42 152.97 40.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.3 mt -60.05 156.38 15.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.3 mtt180 60.9 157.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.882 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.25 -38.24 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.957 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.19 162.02 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.501 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.923 179.988 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.796 0.331 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -88.71 -34.84 17.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -114.15 57.54 0.46 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.507 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.9 161.59 21.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.793 0.33 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -30.92 24.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.415 HD21 ' CZ ' ' A' ' 153' ' ' PHE . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.479 ' CZ ' ' HE3' ' A' ' 120' ' ' MET . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.479 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.479 ' HE3' ' CZ ' ' A' ' 104' ' ' PHE . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.402 ' O ' HG21 ' A' ' 124' ' ' THR . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.415 HG23 ' N ' ' A' ' 125' ' ' GLY . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.415 ' N ' HG23 ' A' ' 124' ' ' THR . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 126' ' ' GLU . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.411 ' CG2' ' HB3' ' A' ' 117' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.426 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.411 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.479 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.467 ' O ' ' N ' ' A' ' 151' ' ' ASP . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . 0.47 ' CB ' HG12 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.442 ' HA ' HD12 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . 0.434 ' CG2' ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.805 0.336 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.47 69.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.41 102.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.633 HG21 HD12 ' B' ' 134' ' ' LEU . 1.7 mm -73.96 142.33 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.17 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.572 ' CD1' HD13 ' B' ' 134' ' ' LEU . 16.8 p90 -102.35 -140.94 0.35 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.965 179.867 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.633 HD12 HG21 ' B' ' 131' ' ' ILE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.434 ' HA ' ' CG2' ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' A' ' 100' ' ' LEU . 32.8 m-85 -151.14 28.44 0.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.45 173.81 7.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.159 -179.74 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.2 OUTLIER -155.91 114.62 2.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.603 179.917 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 3.6 Cg_exo -74.7 -71.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.81 2.34 . . . . 0.0 112.497 -179.533 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 47.4 m 55.66 26.7 9.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -179.801 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 7.3 mt -148.38 152.08 36.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.757 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.73 124.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' B' ' 147' ' ' ARG . 0.3 OUTLIER 58.66 -174.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.074 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.68 -71.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.198 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' B' ' 145' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.045 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.849 0.357 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -84.14 105.8 15.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 92.45 65.32 1.11 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.452 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.52 148.85 48.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.794 0.331 . . . . 0.0 110.821 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.92 -61.22 0.5 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.066 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.469 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.457 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.44 ' CZ ' ' CE ' ' A' ' 120' ' ' MET . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.427 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.488 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' A' ' 120' ' ' MET . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.437 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.409 HG22 ' N ' ' A' ' 125' ' ' GLY . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.409 ' N ' HG22 ' A' ' 124' ' ' THR . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.43 HG23 HD13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.431 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.488 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' HD11 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.469 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.427 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.43 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.825 0.345 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 60.54 160.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -34.35 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 6.3 mm -102.61 134.47 43.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.386 -179.734 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.446 ' CE2' HD12 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -151.18 -93.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.919 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.446 HD12 ' CE2' ' B' ' 132' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 -137.04 31.15 2.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -100.26 -167.66 1.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.875 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.81 157.68 41.1 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.852 179.831 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.6 105.84 2.1 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.259 1.973 . . . . 0.0 112.438 -179.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 57.9 p -76.04 -50.94 13.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 16.2 mt -147.6 -70.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 61.23 85.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -91.09 -43.66 9.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.99 -169.05 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.87 -179.934 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.893 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.6 ttt . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.83 0.348 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.36 81.7 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 88.62 109.6 1.1 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.51 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -51.04 43.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.793 0.33 . . . . 0.0 110.867 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.01 38.72 13.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.943 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.4 ' CD1' HD23 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.419 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.415 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.446 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.507 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.403 ' HB3' ' CG2' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.446 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 127' ' ' THR . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.404 ' HA ' HD22 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.42 ' CD1' HG12 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.4 ' HB3' ' CD1' ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.42 HG12 ' CD1' ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.412 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.414 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.507 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.47 ' O ' HD12 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' A' ' 98' ' ' SER . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.447 ' CA ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.41 HD21 ' CE1' ' A' ' 150' ' ' TYR . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.412 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.771 0.319 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.34 117.25 22.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -32.52 7.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 16.8 mm -94.52 134.01 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.0 179.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.405 ' O ' ' CD2' ' B' ' 132' ' ' PHE . 43.9 p90 -179.01 115.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.881 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CE1' HD21 ' A' ' 100' ' ' LEU . 1.9 m-85 -107.67 29.2 7.43 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -104.37 -167.47 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.451 ' HG3' ' HD2' ' B' ' 141' ' ' PRO . 13.1 tpt180 -108.25 140.83 22.1 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.451 ' HD2' ' HG3' ' B' ' 140' ' ' ARG . 46.6 Cg_exo -57.01 -16.5 21.02 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.626 2.217 . . . . 0.0 113.088 -179.6 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 p -46.52 98.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.375 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 11.6 mt 60.85 156.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.952 179.912 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.57 -45.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -90.6 115.0 27.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 t -76.46 149.65 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.927 179.729 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 tmm? . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.818 0.342 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -137.37 101.13 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -156.65 145.33 11.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -145.23 145.71 31.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.791 0.329 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.472 ' CD2' ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.418 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.439 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.462 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.481 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HD2' ' O ' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.439 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.435 ' O ' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.434 ' O ' ' CG2' ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.447 HG23 HG12 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.447 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.431 HG22 HD13 ' A' ' 133' ' ' ILE . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.444 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.481 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.437 ' O ' HD11 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.423 ' CD1' HD22 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.472 ' CZ ' ' CD2' ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 154' ' ' LEU . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.444 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.78 0.324 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -134.22 -75.04 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -49.55 2.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.438 ' CG2' ' HB2' ' B' ' 134' ' ' LEU . 0.0 OUTLIER -130.12 166.85 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.122 179.85 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -145.64 -94.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.408 -179.673 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.438 ' HB2' ' CG2' ' B' ' 131' ' ' ILE . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.83 -27.24 4.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -54.77 -177.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.059 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -96.04 139.74 21.94 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.036 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.53 -167.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.449 2.1 . . . . 0.0 112.2 179.993 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.3 m -162.01 113.19 1.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mt -113.56 -60.82 1.83 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.86 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -146.6 152.97 39.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.24 88.1 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.21 141.26 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.521 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.884 179.993 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.7 mtm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 -47.0 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.912 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.77 -179.28 1.75 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -121.86 164.82 16.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 0.0 110.878 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t -176.99 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.4 ' CD1' HD23 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.474 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.438 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . 0.435 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.474 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.44 ' HB3' ' CE2' ' A' ' 111' ' ' TYR . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.469 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.431 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 150' ' ' TYR . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.467 ' CZ ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.87 0.367 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -91.21 155.95 18.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -93.34 131.65 38.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 59.14 162.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.045 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.515 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.5 OUTLIER -144.84 -123.0 0.08 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.961 -179.875 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.508 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -29.98 63.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.37 130.37 55.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 -179.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . 0.41 ' HB2' ' CD ' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -77.57 171.65 11.89 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.937 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . 0.41 ' CD ' ' HB2' ' B' ' 140' ' ' ARG . 25.1 Cg_exo -62.6 164.51 18.1 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.376 2.051 . . . . 0.0 112.269 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 82.5 p -148.4 -48.29 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.37 -174.39 5.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.914 -179.923 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -118.62 -52.77 2.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 ptt-85 -133.79 108.95 8.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.47 -45.25 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.975 -179.863 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.802 0.335 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.74 178.41 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.57 -78.19 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt 60.67 77.77 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.877 0.37 . . . . 0.0 110.899 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.59 -43.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.428 ' HA ' ' HB2' ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.427 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.434 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.42 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.502 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.434 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.413 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.402 HG23 ' CE2' ' B' ' 132' ' ' PHE . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.444 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.502 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.501 ' O ' HD11 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.482 ' CE2' ' CD2' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.462 ' CE2' ' HB2' ' A' ' 101' ' ' PHE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.421 ' N ' ' CD2' ' A' ' 154' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.789 0.328 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -85.31 84.46 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' B' ' 131' ' ' ILE . 35.4 mtmt 60.99 -171.41 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.489 ' O ' ' O ' ' B' ' 130' ' ' LYS . 6.2 mm 54.12 135.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.411 0.624 . . . . 0.0 112.257 179.354 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.402 ' CE2' HG23 ' A' ' 124' ' ' THR . 34.4 p90 -179.47 114.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.632 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -130.76 24.7 5.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.49 -30.82 6.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 63.29 136.38 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.735 -179.818 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -88.19 160.96 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.727 2.285 . . . . 0.0 112.568 -179.821 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.02 -65.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.9 mt -144.87 -54.33 0.31 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.948 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -68.27 176.04 2.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -136.89 -47.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.906 179.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.5 t -108.11 155.24 9.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.843 179.888 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.01 151.47 23.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.52 -119.93 1.67 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.527 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 60.63 32.14 20.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 110.934 -179.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t -132.53 -45.85 0.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.419 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.497 ' HB ' ' CG2' ' A' ' 148' ' ' ILE . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.41 ' HE1' ' CE1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' HA ' ' A' ' 129' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.403 ' HA ' ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.459 HG22 HD11 ' A' ' 133' ' ' ILE . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.497 ' CG2' ' HB ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.453 ' O ' HD12 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 150' ' ' TYR . . . . . 0.44 ' CE1' ' CD2' ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . 0.429 ' O ' ' CD1' ' A' ' 153' ' ' PHE . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.468 ' HA ' HD21 ' A' ' 154' ' ' LEU . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 128' ' ' THR . . . . . 0.406 HG23 ' CD1' ' B' ' 132' ' ' PHE . 1.2 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.819 0.342 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 68.5 -68.43 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.972 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -130.92 -43.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 131' ' ' ILE . . . . . 0.44 HG21 ' H ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -135.02 168.53 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.733 179.596 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 132' ' ' PHE . . . . . 0.497 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -146.83 -96.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.773 -179.347 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.407 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -110.65 30.68 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.99 159.25 44.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.91 133.46 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.728 -179.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.14 100.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.437 2.091 . . . . 0.0 112.235 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 142' ' ' THR . . . . . 0.408 ' O ' ' N ' ' B' ' 144' ' ' ARG . 0.7 OUTLIER -90.95 11.62 22.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.397 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 23.5 mt 62.89 -77.15 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.116 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 144' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' B' ' 142' ' ' THR . 1.6 tpt180 68.22 41.19 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.855 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -137.97 42.21 2.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.953 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 60.22 155.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.132 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.832 0.349 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.696 HD13 HD22 ' A' ' 154' ' ' LEU . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.494 HD12 ' HA ' ' A' ' 97' ' ' LEU . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.691 HG23 ' CB ' ' A' ' 116' ' ' GLU . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.847 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.691 ' CB ' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.589 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.594 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.515 ' HG3' HD12 ' A' ' 121' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.807 HD22 HG12 ' A' ' 133' ' ' ILE . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.792 HG21 HD11 ' A' ' 128' ' ' ILE . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.792 HD11 HG21 ' A' ' 124' ' ' THR . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.611 ' HA ' HD23 ' A' ' 121' ' ' LEU . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.807 HG12 HD22 ' A' ' 121' ' ' LEU . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.847 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.61 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.861 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.861 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.475 ' CE1' HD21 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.625 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.609 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 97' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.61 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.586 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.742 HG22 ' HA ' ' B' ' 135' ' ' ARG . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.475 ' O ' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.666 0.269 . . . . 0.0 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' ' 134' ' ' LEU . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.742 ' HA ' HG22 ' A' ' 160' ' ' VAL . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.491 ' HE1' HD13 ' A' ' 100' ' ' LEU . 6.3 m-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.809 0.337 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.654 HD13 ' HB3' ' A' ' 154' ' ' LEU . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.643 HD13 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.776 HG23 ' HB3' ' A' ' 116' ' ' GLU . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.504 ' HG ' HG22 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.776 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.69 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.539 ' HB2' HD21 ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 132' ' ' ASP . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.582 HG23 HD11 ' A' ' 128' ' ' ILE . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.881 HG12 HD23 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.52 ' HA ' HD22 ' A' ' 121' ' ' LEU . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.69 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 117' ' ' LEU . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.757 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.757 ' N ' HD13 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.678 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.458 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.551 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 97' ' ' LEU . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.914 HG22 ' HA ' ' B' ' 135' ' ' ARG . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 134' ' ' LEU . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.914 ' HA ' HG22 ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.835 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.798 HD21 ' CG ' ' A' ' 157' ' ' MET . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.568 HD23 HD23 ' A' ' 97' ' ' LEU . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.799 ' HA ' HD13 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.694 HG23 ' CB ' ' A' ' 116' ' ' GLU . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.694 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.906 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.799 HD13 ' HA ' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.602 ' HB2' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.746 HD11 ' HB3' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.459 HG13 HD23 ' A' ' 121' ' ' LEU . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.553 ' HA ' HD22 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.746 ' HB3' HD11 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.906 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.752 ' HG ' HD11 ' A' ' 117' ' ' LEU . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.486 ' SD ' HD23 ' A' ' 117' ' ' LEU . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.402 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.866 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.866 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.849 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.557 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.7 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.849 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.705 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.798 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.682 HG13 ' CG ' ' B' ' 135' ' ' ARG . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.963 ' O ' HD12 ' B' ' 134' ' ' LEU . 27.2 p90 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.664 0.269 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.963 HD12 ' O ' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.682 ' CG ' HG13 ' A' ' 160' ' ' VAL . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.851 0.358 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.507 ' O ' HD13 ' A' ' 100' ' ' LEU . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.636 ' HA ' HD22 ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.469 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 116' ' ' GLU . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.763 HD23 HG23 ' A' ' 133' ' ' ILE . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.606 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.599 ' SD ' HD21 ' B' ' 134' ' ' LEU . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 1.061 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.402 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.71 HG22 HD12 ' A' ' 121' ' ' LEU . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 1.061 HD11 HD11 ' A' ' 121' ' ' LEU . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.474 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.403 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.824 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.643 ' N ' HD13 ' A' ' 148' ' ' ILE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.548 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.556 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.824 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.575 ' HA ' HD22 ' A' ' 97' ' ' LEU . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.638 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.699 ' O ' HG23 ' A' ' 160' ' ' VAL . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.857 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 111.071 0.026 . . . . 0.0 111.071 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.638 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.857 ' HG3' HG22 ' A' ' 160' ' ' VAL . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.478 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.573 ' CB ' HG21 ' A' ' 160' ' ' VAL . 5.3 m-85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.759 0.314 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 154' ' ' LEU . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.635 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.407 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.431 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.756 HG23 ' CB ' ' A' ' 116' ' ' GLU . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.756 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.724 HD13 ' HE3' ' A' ' 137' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.563 HD12 ' O ' ' A' ' 116' ' ' GLU . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.467 ' HB2' HD21 ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.808 HD11 HG13 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.655 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.426 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.766 ' O ' HG23 ' A' ' 128' ' ' ILE . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.808 HG13 HD11 ' A' ' 121' ' ' LEU . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.76 HG23 HD12 ' A' ' 121' ' ' LEU . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.681 HG23 HD23 ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.724 ' HE3' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.401 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.828 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.828 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.822 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.553 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.751 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.822 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.718 ' SD ' HD11 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.863 HG22 ' HG3' ' B' ' 135' ' ' ARG . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.87 ' O ' HD12 ' B' ' 134' ' ' LEU . 32.6 p90 . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 120.805 0.335 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.87 HD12 ' O ' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.55 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.635 ' CE1' HD21 ' A' ' 100' ' ' LEU . 2.4 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.814 0.34 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.691 HD21 ' HG2' ' A' ' 157' ' ' MET . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 116' ' ' GLU . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.625 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 114' ' ' LEU . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.468 ' HG3' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.893 HD11 HG13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.742 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.893 HG13 HD11 ' A' ' 121' ' ' LEU . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.63 HG22 HD12 ' A' ' 121' ' ' LEU . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.633 ' O ' HD13 ' A' ' 117' ' ' LEU . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.64 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.775 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.69 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.612 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.469 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.69 ' CA ' HD11 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.67 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.691 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.841 HG22 ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.532 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.67 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.841 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.478 ' HE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.856 0.36 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.545 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.804 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 96' ' ' GLU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.422 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.831 HG23 ' HB3' ' A' ' 116' ' ' GLU . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.661 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.831 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.843 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.527 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.674 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 1.063 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.611 HG23 ' HB3' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.482 ' C ' HD13 ' A' ' 128' ' ' ILE . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.917 ' O ' HG23 ' A' ' 129' ' ' THR . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.803 ' H ' HD13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.917 HG23 ' O ' ' A' ' 127' ' ' THR . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 133' ' ' ILE . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.513 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 1.063 HD11 HD11 ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.484 ' HG3' HD11 ' A' ' 114' ' ' LEU . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 117' ' ' LEU . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.492 ' SD ' HD23 ' A' ' 117' ' ' LEU . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.694 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.694 ' N ' HD13 ' A' ' 148' ' ' ILE . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.477 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.804 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.697 ' HA ' HD22 ' A' ' 97' ' ' LEU . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.544 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.713 ' CG ' HD21 ' A' ' 97' ' ' LEU . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.42 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.84 HG22 ' HG3' ' B' ' 135' ' ' ARG . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.492 ' HD2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 119.97 -0.062 . . . . 0.0 111.074 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.573 HD12 ' C ' ' B' ' 133' ' ' ASP . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.84 ' HG3' HG22 ' A' ' 160' ' ' VAL . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.634 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.604 ' CB ' HG21 ' A' ' 160' ' ' VAL . 1.5 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.795 0.331 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 157' ' ' MET . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.574 HD12 ' SD ' ' A' ' 157' ' ' MET . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.454 ' CE1' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.417 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.413 ' HG ' HG22 ' A' ' 133' ' ' ILE . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.75 ' CB ' HG23 ' A' ' 112' ' ' ILE . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.548 HD21 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.523 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.454 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.923 HD12 HD11 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.499 ' OG1' HD23 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.751 ' O ' HG23 ' A' ' 128' ' ' ILE . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.751 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.412 ' H ' HD11 ' A' ' 121' ' ' LEU . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.595 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.923 HD11 HD12 ' A' ' 121' ' ' LEU . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.548 ' N ' HD21 ' A' ' 117' ' ' LEU . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.859 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.859 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.716 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.842 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.716 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.844 ' HG3' HD21 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.687 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.548 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.548 HD13 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.687 ' HA ' HG22 ' A' ' 160' ' ' VAL . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.47 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.838 0.352 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.492 ' HG3' HD13 ' A' ' 154' ' ' LEU . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.879 HD22 ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.48 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.785 ' CD1' HD23 ' A' ' 97' ' ' LEU . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.449 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.479 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' CB ' ' A' ' 116' ' ' GLU . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.701 HD23 ' HG3' ' A' ' 134' ' ' GLU . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.556 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.601 HD11 ' HB2' ' A' ' 137' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.529 HD12 ' CA ' ' A' ' 116' ' ' GLU . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.518 ' SD ' HD21 ' A' ' 136' ' ' LEU . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.772 HG23 ' H ' ' A' ' 126' ' ' GLU . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.772 ' H ' HG23 ' A' ' 124' ' ' THR . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.491 HD11 HD13 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.473 ' CB ' HD12 ' A' ' 128' ' ' ILE . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.493 ' CD1' HD13 ' A' ' 121' ' ' LEU . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.701 ' HG3' HD23 ' A' ' 114' ' ' LEU . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.518 HD21 ' SD ' ' A' ' 120' ' ' MET . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.601 ' HB2' HD11 ' A' ' 117' ' ' LEU . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.429 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.832 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.751 ' N ' HD13 ' A' ' 148' ' ' ILE . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.48 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.615 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.879 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.671 ' HA ' HD13 ' A' ' 97' ' ' LEU . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.464 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.762 ' HG3' HD21 ' A' ' 97' ' ' LEU . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.763 HG22 ' HG3' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 110.799 -0.074 . . . . 0.0 110.799 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.763 ' HG3' HG22 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.849 0.357 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.639 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 100' ' ' LEU . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.449 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.629 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.867 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.629 ' CB ' HG23 ' A' ' 112' ' ' ILE . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.752 ' HA ' HD12 ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.603 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.679 HD13 ' HG1' ' A' ' 124' ' ' THR . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' B' ' 132' ' ' PHE . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.751 HG21 HD11 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.554 HG23 HG12 ' A' ' 128' ' ' ILE . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.751 HD11 HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.48 HG22 HD11 ' A' ' 121' ' ' LEU . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.666 ' CB ' HD12 ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.867 ' HG2' HD21 ' A' ' 114' ' ' LEU . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.805 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.454 ' HB2' HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.416 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.684 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.547 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.518 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.48 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.684 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.633 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.805 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.639 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.912 HG22 ' HA ' ' B' ' 135' ' ' ARG . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.724 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.513 ' N ' HD12 ' B' ' 134' ' ' LEU . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.912 ' HA ' HG22 ' A' ' 160' ' ' VAL . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.708 ' HB3' HG21 ' A' ' 160' ' ' VAL . 9.3 m-85 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.709 HD13 ' HE2' ' B' ' 138' ' ' PHE . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.577 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.726 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.784 HD23 ' CG2' ' A' ' 133' ' ' ILE . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.577 ' CB ' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.726 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' CD2' ' B' ' 134' ' ' LEU . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.82 HD21 ' CG1' ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.606 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.634 ' C ' HD13 ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 128' ' ' ILE . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.82 ' CG1' HD21 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.431 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.784 ' CG2' HD23 ' A' ' 114' ' ' LEU . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.768 ' HG3' HD21 ' A' ' 114' ' ' LEU . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.52 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.405 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.733 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.692 ' N ' HD13 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.583 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.512 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.733 ' N ' HD11 ' A' ' 148' ' ' ILE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.52 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HG3' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.565 ' CE2' HG21 ' A' ' 124' ' ' THR . 41.6 p90 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 120' ' ' MET . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' A' ' 160' ' ' VAL . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.592 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.709 ' HE2' HD13 ' A' ' 100' ' ' LEU . 3.3 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.702 0.287 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 157' ' ' MET . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.764 HG23 ' HB2' ' A' ' 116' ' ' GLU . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.764 ' HB2' HG23 ' A' ' 112' ' ' ILE . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.788 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.411 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 1.003 HD21 HG22 ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.762 HG21 HD11 ' A' ' 128' ' ' ILE . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.879 ' O ' HG23 ' A' ' 129' ' ' THR . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.762 HD11 HG21 ' A' ' 124' ' ' THR . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' THR . . . . . 1.003 HG22 HD21 ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.442 ' HB3' HD12 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.788 HG23 ' HB3' ' A' ' 117' ' ' LEU . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.415 ' SD ' HD23 ' A' ' 117' ' ' LEU . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.756 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.756 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.481 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.594 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.466 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.607 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.796 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.463 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HA ' HG22 ' A' ' 160' ' ' VAL . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.662 ' HB3' HG21 ' A' ' 160' ' ' VAL . 12.2 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.828 0.347 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.732 HD13 HD22 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' B' ' 138' ' ' PHE . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.71 HG23 ' HB2' ' A' ' 116' ' ' GLU . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.604 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.71 ' HB2' HG23 ' A' ' 112' ' ' ILE . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.744 HD21 ' HB3' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.641 ' HG3' HD12 ' A' ' 121' ' ' LEU . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.965 HD22 HD13 ' A' ' 133' ' ' ILE . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 121' ' ' LEU . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.898 ' O ' HG23 ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.818 HG22 ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.818 ' CB ' HG22 ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.965 HD13 HD22 ' A' ' 121' ' ' LEU . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.821 HD21 HD21 ' B' ' 134' ' ' LEU . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.828 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.741 ' N ' HD13 ' A' ' 148' ' ' ILE . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.804 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.566 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.828 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.804 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.439 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.648 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.919 HG22 ' HA ' ' B' ' 135' ' ' ARG . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 110.677 -0.12 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.821 HD21 HD21 ' A' ' 136' ' ' LEU . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.919 ' HA ' HG22 ' A' ' 160' ' ' VAL . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.806 ' CE1' HD13 ' A' ' 100' ' ' LEU . 14.1 m-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.821 0.344 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 100' ' ' LEU . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 97' ' ' LEU . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.447 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 116' ' ' GLU . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.571 ' O ' HD12 ' A' ' 119' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.809 HD23 ' HE1' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.638 ' HG2' HD11 ' A' ' 121' ' ' LEU . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.571 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.809 ' HE1' HD23 ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 122' ' ' GLN . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.731 ' N ' HD12 ' A' ' 121' ' ' LEU . 9.6 mm100 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.68 HG21 ' HB2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.494 HD12 ' CB ' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 132' ' ' ASP . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 129' ' ' THR . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.659 ' H ' HG23 ' A' ' 129' ' ' THR . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 136' ' ' LEU . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.477 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.411 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.695 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.829 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.835 ' CG ' HD11 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.678 HG13 ' HG3' ' B' ' 135' ' ' ARG . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.68 ' HB2' HG21 ' A' ' 124' ' ' THR . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.913 -0.032 . . . . 0.0 110.913 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.55 ' HB2' HG23 ' A' ' 124' ' ' THR . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 120' ' ' MET . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.678 ' HG3' HG13 ' A' ' 160' ' ' VAL . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.574 ' HE2' HD21 ' A' ' 100' ' ' LEU . 92.1 m-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 120.582 0.23 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.668 HD12 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.441 ' O ' HD13 ' A' ' 119' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.618 HG23 ' CB ' ' A' ' 116' ' ' GLU . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.703 ' O ' HD23 ' A' ' 117' ' ' LEU . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 134' ' ' GLU . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.618 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.589 HD12 ' CA ' ' A' ' 116' ' ' GLU . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.733 ' SD ' HD21 ' B' ' 134' ' ' LEU . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 120' ' ' MET . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.421 ' O ' HD22 ' A' ' 121' ' ' LEU . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.668 HD12 HD21 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 132' ' ' ASP . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.655 ' HB3' HD13 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.642 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' A' ' 114' ' ' LEU . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.569 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.641 ' SD ' HD21 ' A' ' 117' ' ' LEU . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.403 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.724 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.724 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.609 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.609 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.569 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.772 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.795 HG22 ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-O 120.207 0.051 . . . . 0.0 111.005 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.733 HD21 ' SD ' ' A' ' 120' ' ' MET . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' B' ' 138' ' ' PHE . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.668 ' CE2' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.816 0.341 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 154' ' ' LEU . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.884 HD21 ' CG ' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.409 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.773 HD23 HD23 ' A' ' 97' ' ' LEU . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.474 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.821 HG23 ' HB3' ' A' ' 116' ' ' GLU . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.618 HD23 HG22 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.821 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.726 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 121' ' ' LEU . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.401 ' N ' HD13 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.533 ' CG2' HD22 ' A' ' 121' ' ' LEU . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.514 ' O ' HG23 ' A' ' 128' ' ' ILE . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.689 ' O ' HG23 ' A' ' 129' ' ' THR . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 121' ' ' LEU . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 127' ' ' THR . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.726 HG23 ' HB3' ' A' ' 117' ' ' LEU . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.521 HD21 ' CD2' ' B' ' 134' ' ' LEU . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.46 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.794 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.734 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.56 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.794 ' N ' HD11 ' A' ' 148' ' ' ILE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.778 ' HA ' HD13 ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.671 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.884 ' CG ' HD21 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.676 HG13 ' CG ' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 110.669 -0.123 . . . . 0.0 110.669 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.671 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.676 ' CG ' HG13 ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 71.5 m-85 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.75 0.309 . . . . 0.0 110.964 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.789 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.789 HD12 ' HA ' ' A' ' 97' ' ' LEU . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.412 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 116' ' ' GLU . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.942 HD13 HD12 ' A' ' 117' ' ' LEU . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.752 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.942 HD12 HD13 ' A' ' 114' ' ' LEU . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.518 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.528 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.526 HG21 HG21 ' A' ' 127' ' ' THR . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.583 ' O ' HD13 ' A' ' 128' ' ' ILE . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.724 HG22 HG22 ' A' ' 129' ' ' THR . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.724 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.437 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' A' ' 121' ' ' LEU . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.791 HD21 HD21 ' B' ' 134' ' ' LEU . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.414 ' HE1' ' HA2' ' A' ' 146' ' ' GLY . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.434 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.414 ' HA2' ' HE1' ' A' ' 137' ' ' MET . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.768 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.459 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.457 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.768 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.669 HD22 HD13 ' A' ' 97' ' ' LEU . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.512 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.643 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.816 HG21 ' HB2' ' B' ' 138' ' ' PHE . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.791 HD21 HD21 ' A' ' 136' ' ' LEU . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.603 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.816 ' HB2' HG21 ' A' ' 160' ' ' VAL . 6.3 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.827 HD21 ' HG3' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.951 HD13 ' HE1' ' A' ' 157' ' ' MET . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.554 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.52 ' HD2' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.44 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.807 HG22 HD12 ' A' ' 117' ' ' LEU . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.439 ' O ' HD13 ' A' ' 117' ' ' LEU . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.775 ' CB ' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.807 HD12 HG22 ' A' ' 112' ' ' ILE . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HA ' HD11 ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.64 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.464 ' CD2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.887 ' O ' HG23 ' A' ' 129' ' ' THR . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.887 HG23 ' O ' ' A' ' 127' ' ' THR . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.413 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.728 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.4 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.816 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.774 ' N ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.615 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.601 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.816 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.706 HD22 HD13 ' A' ' 97' ' ' LEU . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.951 ' HE1' HD13 ' A' ' 100' ' ' LEU . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.854 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.947 ' O ' HD12 ' B' ' 134' ' ' LEU . 3.5 p90 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.685 0.279 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.947 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.854 ' HG3' HG22 ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.681 HD13 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.428 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.453 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.769 HG23 ' HB2' ' A' ' 116' ' ' GLU . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.635 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.769 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.766 HD11 ' SD ' ' A' ' 137' ' ' MET . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 116' ' ' GLU . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.528 HD13 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.528 ' CG2' HD13 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.466 ' N ' HG23 ' A' ' 124' ' ' THR . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 128' ' ' ILE . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.583 HG21 ' HB2' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.44 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.583 ' HB2' HG21 ' A' ' 128' ' ' ILE . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.413 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.672 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.766 ' SD ' HD11 ' A' ' 117' ' ' LEU . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.835 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.731 ' N ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.55 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.607 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 97' ' ' LEU . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.672 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.749 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.563 HG21 ' CB ' ' B' ' 138' ' ' PHE . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.531 HD13 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.515 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.681 ' CE1' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 97' ' ' LEU . 47.2 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.842 0.353 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.402 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.697 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.779 ' O ' HD23 ' A' ' 117' ' ' LEU . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.697 ' CB ' HG23 ' A' ' 112' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.871 ' CB ' HG23 ' A' ' 133' ' ' ILE . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HA ' HD11 ' A' ' 133' ' ' ILE . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.456 ' HB2' HD21 ' B' ' 134' ' ' LEU . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.749 HD13 HG13 ' A' ' 133' ' ' ILE . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' HD2' ' B' ' 132' ' ' PHE . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.537 ' O ' HG22 ' A' ' 127' ' ' THR . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.636 HD12 ' CD2' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.485 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.702 ' HB3' HD21 ' A' ' 121' ' ' LEU . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.871 HG23 ' CB ' ' A' ' 117' ' ' LEU . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.819 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.664 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.648 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.653 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.819 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.681 HD22 HD13 ' A' ' 97' ' ' LEU . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.751 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.7 OUTLIER . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 119.945 -0.074 . . . . 0.0 111.04 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.816 ' C ' HD12 ' B' ' 134' ' ' LEU . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.816 HD12 ' C ' ' B' ' 133' ' ' ASP . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.892 ' HA ' HG22 ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.769 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.804 0.335 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.865 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 97' ' ' LEU . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.933 ' HA ' HD13 ' A' ' 119' ' ' ILE . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.804 HG23 ' HB3' ' A' ' 116' ' ' GLU . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.629 ' O ' HD12 ' A' ' 117' ' ' LEU . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.426 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.804 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.933 HD13 ' HA ' ' A' ' 104' ' ' PHE . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.446 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.693 HD11 HD11 ' A' ' 133' ' ' ILE . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.828 ' HB1' ' HB2' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.883 HG22 ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' HD13 ' A' ' 128' ' ' ILE . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.479 HD13 ' O ' ' A' ' 127' ' ' THR . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.434 ' OD1' HD12 ' A' ' 128' ' ' ILE . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.72 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.668 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.728 ' N ' HD13 ' A' ' 148' ' ' ILE . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.702 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.865 HD22 HD13 ' A' ' 97' ' ' LEU . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.808 ' SD ' HD11 ' A' ' 97' ' ' LEU . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.41 ' N ' ' HG3' ' A' ' 157' ' ' MET . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' B' ' 135' ' ' ARG . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.883 ' CD1' HG22 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.828 ' HB2' ' HB1' ' A' ' 123' ' ' ALA . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.549 HD13 ' CD1' ' B' ' 132' ' ' PHE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.668 ' HG3' HG13 ' A' ' 160' ' ' VAL . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.78 0.324 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.913 HD13 ' HA ' ' A' ' 154' ' ' LEU . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.797 HD12 HD23 ' A' ' 97' ' ' LEU . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.805 ' HA ' HD13 ' A' ' 119' ' ' ILE . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.677 HG23 ' CB ' ' A' ' 116' ' ' GLU . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.417 HD21 ' CG ' ' A' ' 134' ' ' GLU . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.677 ' CB ' HG23 ' A' ' 112' ' ' ILE . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.437 ' HA ' HD12 ' A' ' 133' ' ' ILE . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 104' ' ' PHE . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.892 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 132' ' ' ASP . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.664 ' HB3' ' CD1' ' B' ' 134' ' ' LEU . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.724 HG23 HD13 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.649 HG22 HG22 ' A' ' 129' ' ' THR . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 128' ' ' ILE . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.61 ' HB3' HD21 ' A' ' 121' ' ' LEU . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 117' ' ' LEU . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.417 ' CG ' HD21 ' A' ' 114' ' ' LEU . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.548 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.447 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.811 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.811 ' N ' HD13 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.407 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.696 ' N ' HD11 ' A' ' 148' ' ' ILE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.913 ' HA ' HD13 ' A' ' 97' ' ' LEU . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.472 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.548 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.788 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.94 HG22 ' HG3' ' B' ' 135' ' ' ARG . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.688 ' CD1' HD22 ' B' ' 134' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.724 HD13 HG23 ' A' ' 124' ' ' THR . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.94 ' HG3' HG22 ' A' ' 160' ' ' VAL . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 136' ' ' GLY . . . . . 0.425 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.85 0.357 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.851 HD11 ' CG ' ' A' ' 157' ' ' MET . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.431 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.659 HD12 HD23 ' A' ' 97' ' ' LEU . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.407 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 116' ' ' GLU . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 117' ' ' LEU . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.75 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 133' ' ' ILE . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.7 ' HB3' HD21 ' B' ' 134' ' ' LEU . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.577 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.493 HG21 HG22 ' A' ' 127' ' ' THR . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.436 ' N ' HG23 ' A' ' 124' ' ' THR . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 124' ' ' THR . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.619 HG21 ' CG ' ' A' ' 132' ' ' ASP . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.52 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.468 ' HB2' HG23 ' A' ' 129' ' ' THR . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.619 ' CG ' HG21 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.654 ' O ' HD13 ' A' ' 117' ' ' LEU . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.53 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.623 ' HB2' HD11 ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.431 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.87 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.87 ' N ' HD13 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.433 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.785 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.772 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.414 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.53 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.851 ' CG ' HD11 ' A' ' 97' ' ' LEU . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG13 ' HG2' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.732 ' O ' HD12 ' B' ' 134' ' ' LEU . 34.8 p90 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.732 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG2' HG13 ' A' ' 160' ' ' VAL . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.436 ' O ' HD12 ' A' ' 97' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.778 0.323 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HG2' ' A' ' 157' ' ' MET . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.9 HD13 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.447 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.676 ' CD2' HD13 ' A' ' 112' ' ' ILE . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.816 HG23 ' HB3' ' A' ' 116' ' ' GLU . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.404 ' O ' HD23 ' A' ' 117' ' ' LEU . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 137' ' ' MET . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.816 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.777 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.495 HD12 ' CA ' ' A' ' 116' ' ' GLU . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.554 ' SD ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.928 HD12 HD11 ' A' ' 133' ' ' ILE . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.452 HG21 HG22 ' A' ' 127' ' ' THR . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.909 HG23 HG12 ' A' ' 128' ' ' ILE . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.909 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.847 ' HA ' HD11 ' A' ' 121' ' ' LEU . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.844 ' HB2' HD12 ' A' ' 128' ' ' ILE . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.928 HD11 HD12 ' A' ' 121' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.58 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 114' ' ' LEU . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.734 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.662 ' N ' HD13 ' A' ' 148' ' ' ILE . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.537 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.646 ' C ' HD11 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.734 ' N ' HD11 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.537 HD22 HD13 ' A' ' 97' ' ' LEU . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.58 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.935 HG22 ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.665 ' CE1' HD11 ' B' ' 134' ' ' LEU . 16.8 p90 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 119.901 -0.095 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.665 HD11 ' CE1' ' B' ' 132' ' ' PHE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.935 ' HA ' HG22 ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 100' ' ' LEU . 32.8 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.776 0.322 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.493 ' CG ' HD13 ' A' ' 154' ' ' LEU . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.932 HD23 HD12 ' A' ' 100' ' ' LEU . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.932 HD12 HD23 ' A' ' 97' ' ' LEU . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.649 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.457 ' O ' HD13 ' A' ' 117' ' ' LEU . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.649 ' CB ' HG23 ' A' ' 112' ' ' ILE . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.812 ' HB3' HG23 ' A' ' 133' ' ' ILE . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.674 HD11 ' CG1' ' A' ' 128' ' ' ILE . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.489 HG21 ' CE2' ' B' ' 132' ' ' PHE . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.678 ' CG ' HD12 ' A' ' 128' ' ' ILE . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.678 HD12 ' CG ' ' A' ' 126' ' ' GLU . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.812 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.457 ' HG3' HD23 ' A' ' 114' ' ' LEU . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.523 HD21 ' CD2' ' B' ' 134' ' ' LEU . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.414 ' CA ' HD21 ' A' ' 117' ' ' LEU . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.836 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.736 ' CE1' HD21 ' A' ' 154' ' ' LEU . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.651 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.736 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.458 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.663 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.824 ' HG3' HD21 ' A' ' 97' ' ' LEU . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 157' ' ' MET . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.431 0.157 . . . . 0.0 110.919 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 133' ' ' ASP . . . . . 0.422 ' C ' HD12 ' B' ' 134' ' ' LEU . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.663 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.65 ' HG3' HG13 ' A' ' 160' ' ' VAL . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' A' ' 100' ' ' LEU . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.408 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.796 ' HD3' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 116' ' ' GLU . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 134' ' ' GLU . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.844 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.686 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.796 HD11 ' HD3' ' A' ' 106' ' ' LYS . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.686 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.529 HD22 HD11 ' A' ' 133' ' ' ILE . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 121' ' ' LEU . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.771 HD12 ' HB3' ' A' ' 132' ' ' ASP . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.771 ' HB3' HD12 ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.765 HG12 HD11 ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' A' ' 114' ' ' LEU . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.444 ' HG3' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.439 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.407 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.87 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.778 ' N ' HD13 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.668 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.514 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.87 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.727 HD22 HD13 ' A' ' 97' ' ' LEU . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.599 ' HG2' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.527 HG22 ' HA ' ' B' ' 135' ' ' ARG . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.421 ' N ' HD12 ' B' ' 134' ' ' LEU . 43.9 p90 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.781 0.324 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.421 HD12 ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.527 ' HA ' HG22 ' A' ' 160' ' ' VAL . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 160' ' ' VAL . 1.9 m-85 . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.773 0.32 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.45 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.77 ' CD ' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.693 HG23 ' HB2' ' A' ' 116' ' ' GLU . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.517 HD21 ' HG3' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.693 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.696 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.534 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.77 HD11 ' CD ' ' A' ' 106' ' ' LYS . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.935 HD13 HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.935 HG23 HD13 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.623 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.63 ' O ' HG22 ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.753 ' O ' HG23 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.696 HG23 ' HB3' ' A' ' 117' ' ' LEU . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' HD21 ' A' ' 114' ' ' LEU . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.445 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.453 ' HA ' HD11 ' A' ' 117' ' ' LEU . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.81 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.74 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.923 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.596 ' C ' HD11 ' A' ' 148' ' ' ILE . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.923 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.445 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.659 ' HG3' HD21 ' A' ' 97' ' ' LEU . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 111.408 0.151 . . . . 0.0 111.408 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.615 HD13 ' CE2' ' B' ' 138' ' ' PHE . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.791 HG23 ' HB3' ' A' ' 116' ' ' GLU . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.791 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.81 HD12 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.5 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.551 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.75 HD21 HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.766 ' O ' HD11 ' A' ' 128' ' ' ILE . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.657 ' O ' HD13 ' A' ' 128' ' ' ILE . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.432 ' O ' HG23 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.766 HD11 ' O ' ' A' ' 124' ' ' THR . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.713 HG22 ' HG ' ' A' ' 121' ' ' LEU . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.81 HG23 HD12 ' A' ' 117' ' ' LEU . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.54 HD21 ' HZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 147' ' ' ARG . . . . . 0.433 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.848 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.644 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.691 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.55 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.848 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 97' ' ' LEU . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.592 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.773 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.6 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.5 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.039 -0.029 . . . . 0.0 110.961 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.615 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.839 0.352 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.786 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 116' ' ' GLU . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.588 ' H ' HD22 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' HD21 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 128' ' ' ILE . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.488 HG23 ' N ' ' A' ' 125' ' ' GLY . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 125' ' ' GLY . . . . . 0.488 ' N ' HG23 ' A' ' 124' ' ' THR . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.487 HG22 ' N ' ' A' ' 128' ' ' ILE . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.521 HD13 ' CB ' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 133' ' ' ILE . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.521 ' CB ' HD13 ' A' ' 128' ' ' ILE . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.584 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 137' ' ' MET . . . . . 0.486 ' HG3' HD13 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 140' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.735 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.64 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.518 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.719 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.659 ' CB ' HD13 ' A' ' 97' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.584 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.665 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.623 HG22 ' HG3' ' B' ' 135' ' ' ARG . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 34.4 p90 . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 120.735 0.302 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.408 HD21 ' HB3' ' A' ' 120' ' ' MET . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.623 ' HG3' HG22 ' A' ' 160' ' ' VAL . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.535 ' HE2' HD13 ' A' ' 100' ' ' LEU . 8.7 m-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.825 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.495 HD13 ' HE1' ' B' ' 138' ' ' PHE . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 116' ' ' GLU . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.752 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.528 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.803 HD13 ' OG1' ' A' ' 124' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.803 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.477 ' O ' HG23 ' A' ' 129' ' ' THR . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.729 HG13 HD11 ' A' ' 121' ' ' LEU . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 129' ' ' THR . . . . . 0.504 HG22 ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 117' ' ' LEU . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.604 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 148' ' ' ILE . . . . . 0.787 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 150' ' ' TYR . . . . . 0.964 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 152' ' ' GLU . . . . . 0.432 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 153' ' ' PHE . . . . . 0.825 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.964 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 156' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 160' ' ' VAL . . . . . 0.767 HG22 ' HG3' ' B' ' 135' ' ' ARG . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 132' ' ' PHE . . . . . 0.63 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 134' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HG3' HG22 ' A' ' 160' ' ' VAL . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 138' ' ' PHE . . . . . 0.495 ' HE1' HD13 ' A' ' 100' ' ' LEU . 3.1 m-85 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.809 0.338 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -83.28 161.3 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.871 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -142.86 163.26 27.35 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.501 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -84.85 106.57 16.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 -45.8 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.696 HD13 HD22 ' A' ' 154' ' ' LEU . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.494 HD12 ' HA ' ' A' ' 97' ' ' LEU . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.691 HG23 ' CB ' ' A' ' 116' ' ' GLU . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.847 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.691 ' CB ' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.589 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.594 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.515 ' HG3' HD12 ' A' ' 121' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.807 HD22 HG12 ' A' ' 133' ' ' ILE . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.792 HG21 HD11 ' A' ' 128' ' ' ILE . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.792 HD11 HG21 ' A' ' 124' ' ' THR . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.611 ' HA ' HD23 ' A' ' 121' ' ' LEU . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.807 HG12 HD22 ' A' ' 121' ' ' LEU . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.847 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.61 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.861 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.861 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.475 ' CE1' HD21 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.625 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.609 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 97' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.61 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.586 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.742 HG22 ' HA ' ' B' ' 135' ' ' ARG . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 23.7 p . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.431 ' O ' ' CB ' ' B' ' 130' ' ' LYS . 4.3 mt-30 -136.49 -75.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' B' ' 129' ' ' GLN . 1.3 mtmm 84.04 -30.8 0.08 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.913 HD12 ' HB2' ' B' ' 135' ' ' ARG . 15.0 mm -86.74 133.93 28.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.857 0.36 . . . . 0.0 111.092 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.475 ' O ' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 -175.66 98.35 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.956 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' ' 134' ' ' LEU . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.913 ' HB2' HD12 ' B' ' 131' ' ' ILE . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.491 ' HE1' HD13 ' A' ' 100' ' ' LEU . 6.3 m-85 -134.72 29.86 3.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -103.41 -50.27 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.768 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.13 146.4 5.38 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -83.05 113.2 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.435 2.09 . . . . 0.0 112.419 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 2.8 t -115.89 138.87 50.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.3 111.25 8.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -95.92 114.81 26.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.955 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -76.68 138.36 39.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.8 -45.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.157 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.438 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 5.4 tpp180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.144 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.895 0.378 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -125.08 -50.14 1.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.51 -151.82 9.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.516 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -131.47 88.59 2.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.23 172.9 14.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.791 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.654 HD13 ' HB3' ' A' ' 154' ' ' LEU . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.643 HD13 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.776 HG23 ' HB3' ' A' ' 116' ' ' GLU . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.504 ' HG ' HG22 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.776 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.69 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.539 ' HB2' HD21 ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 132' ' ' ASP . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.582 HG23 HD11 ' A' ' 128' ' ' ILE . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.881 HG12 HD23 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.52 ' HA ' HD22 ' A' ' 121' ' ' LEU . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.69 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 117' ' ' LEU . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.757 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.757 ' N ' HD13 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.678 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.458 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.551 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 97' ' ' LEU . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.914 HG22 ' HA ' ' B' ' 135' ' ' ARG . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.826 0.346 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -139.05 31.29 2.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 mtmt 60.64 101.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.991 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.656 ' N ' HD12 ' B' ' 131' ' ' ILE . 0.0 OUTLIER -144.72 165.94 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.937 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -144.81 -98.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.594 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 134' ' ' LEU . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.914 ' HA ' HG22 ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.835 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER -134.08 30.32 3.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm -112.03 -61.44 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.12 137.25 12.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.967 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -88.91 134.8 2.7 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.582 2.188 . . . . 0.0 112.577 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.491 HG22 ' H ' ' B' ' 143' ' ' LEU . 0.2 OUTLIER 56.05 178.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 179.757 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.491 ' H ' HG22 ' B' ' 142' ' ' THR . 76.7 mt 61.63 -81.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 61.96 121.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.934 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 63.2 165.64 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.85 -45.5 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.123 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.443 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.171 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.775 0.322 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt 61.24 112.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -140.6 -81.98 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.57 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -27.2 7.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.671 0.272 . . . . 0.0 111.155 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t -94.96 -63.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.798 HD21 ' CG ' ' A' ' 157' ' ' MET . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.568 HD23 HD23 ' A' ' 97' ' ' LEU . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.799 ' HA ' HD13 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.694 HG23 ' CB ' ' A' ' 116' ' ' GLU . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.694 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.906 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.799 HD13 ' HA ' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.602 ' HB2' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.746 HD11 ' HB3' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.459 HG13 HD23 ' A' ' 121' ' ' LEU . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.553 ' HA ' HD22 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.746 ' HB3' HD11 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.906 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.752 ' HG ' HD11 ' A' ' 117' ' ' LEU . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.486 ' SD ' HD23 ' A' ' 117' ' ' LEU . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.402 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.866 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.866 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.849 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.557 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.7 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.849 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.705 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.798 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.682 HG13 ' CG ' ' B' ' 135' ' ' ARG . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.791 0.329 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -110.6 -30.43 7.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.051 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 39.5 mmtt -109.22 84.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.039 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.846 HD12 ' HB2' ' B' ' 135' ' ' ARG . 13.2 mm -87.66 147.12 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.739 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.963 ' O ' HD12 ' B' ' 134' ' ' LEU . 27.2 p90 -176.91 106.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.106 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.963 HD12 ' O ' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.846 ' HB2' HD12 ' B' ' 131' ' ' ILE . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 -131.24 27.28 4.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.25 -179.1 5.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.007 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.404 ' NE ' ' HD2' ' B' ' 141' ' ' PRO . 6.3 tpt180 -137.3 139.88 29.15 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.892 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.404 ' HD2' ' NE ' ' B' ' 140' ' ' ARG . 97.5 Cg_endo -88.82 104.47 0.42 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.812 2.341 . . . . 0.0 112.53 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 8.6 m -92.84 -57.33 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.72 112.1 16.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.71 100.04 2.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 39.9 ptt85 -99.51 151.2 21.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.13 154.78 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.482 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.872 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 14.5 ptm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.871 0.367 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -155.97 148.81 24.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -97.57 70.36 0.72 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.541 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -73.05 155.45 39.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -159.67 -45.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.507 ' O ' HD13 ' A' ' 100' ' ' LEU . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.636 ' HA ' HD22 ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.469 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 116' ' ' GLU . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.763 HD23 HG23 ' A' ' 133' ' ' ILE . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.606 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.599 ' SD ' HD21 ' B' ' 134' ' ' LEU . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 1.061 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.402 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.71 HG22 HD12 ' A' ' 121' ' ' LEU . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 1.061 HD11 HD11 ' A' ' 121' ' ' LEU . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.474 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.403 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.824 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.643 ' N ' HD13 ' A' ' 148' ' ' ILE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.548 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.556 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.824 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.575 ' HA ' HD22 ' A' ' 97' ' ' LEU . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.638 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.699 ' O ' HG23 ' A' ' 160' ' ' VAL . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.857 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' THR . . . . . 0.507 HG23 ' O ' ' B' ' 128' ' ' THR . 6.7 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.852 0.358 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -125.45 103.03 7.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.891 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt 68.12 -63.12 0.34 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.186 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.733 ' H ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -112.21 172.64 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 0.0 110.972 179.856 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.568 ' H ' HG22 ' B' ' 131' ' ' ILE . 0.2 OUTLIER -147.16 -107.78 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.071 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.638 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.857 ' HG3' HG22 ' A' ' 160' ' ' VAL . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.478 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.573 ' CB ' HG21 ' A' ' 160' ' ' VAL . 5.3 m-85 -69.06 64.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.638 ' CG ' HG12 ' A' ' 160' ' ' VAL . 8.0 mttt -123.24 -76.79 0.59 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -147.53 139.85 14.27 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.92 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -56.84 122.94 12.7 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.468 2.112 . . . . 0.0 112.224 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.2 p -131.75 -51.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 14.1 mt -145.61 125.3 13.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.67 -53.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -157.31 153.01 26.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.446 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.7 p -43.03 -45.24 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.348 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.446 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 14.6 mmm180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.06 97.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.61 50.0 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.538 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -140.69 -54.87 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.369 . . . . 0.0 110.902 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m -91.17 -27.94 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 154' ' ' LEU . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.635 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.407 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.431 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.756 HG23 ' CB ' ' A' ' 116' ' ' GLU . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.756 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.724 HD13 ' HE3' ' A' ' 137' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.563 HD12 ' O ' ' A' ' 116' ' ' GLU . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.467 ' HB2' HD21 ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.808 HD11 HG13 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.655 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.426 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.766 ' O ' HG23 ' A' ' 128' ' ' ILE . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.808 HG13 HD11 ' A' ' 121' ' ' LEU . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.76 HG23 HD12 ' A' ' 121' ' ' LEU . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.681 HG23 HD23 ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.724 ' HE3' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.401 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.828 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.828 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.822 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.553 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.751 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.822 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.718 ' SD ' HD11 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.863 HG22 ' HG3' ' B' ' 135' ' ' ARG . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.3 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.802 0.334 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -163.71 40.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.965 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.415 ' O ' ' CE1' ' B' ' 132' ' ' PHE . 0.2 OUTLIER 70.01 -63.39 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.078 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.503 HG23 ' HB2' ' B' ' 135' ' ' ARG . 12.8 mm -78.4 152.2 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.173 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.87 ' O ' HD12 ' B' ' 134' ' ' LEU . 32.6 p90 178.34 109.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.217 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.87 HD12 ' O ' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.55 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.635 ' CE1' HD21 ' A' ' 100' ' ' LEU . 2.4 m-85 -72.98 58.81 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.597 ' HG2' HG12 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -168.5 -169.92 1.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.669 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.94 154.13 64.22 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.914 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -84.58 -175.47 2.14 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.586 2.191 . . . . 0.0 112.512 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.5 123.76 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 39.1 mt 60.15 159.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.17 155.23 41.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 62.79 39.0 11.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -70.96 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.286 -179.732 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.814 0.34 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm 60.29 179.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -160.73 95.24 0.14 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.547 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.57 -174.89 5.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.28 -59.98 1.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.867 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.691 HD21 ' HG2' ' A' ' 157' ' ' MET . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 116' ' ' GLU . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.625 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 114' ' ' LEU . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.468 ' HG3' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.893 HD11 HG13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.742 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.893 HG13 HD11 ' A' ' 121' ' ' LEU . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.63 HG22 HD12 ' A' ' 121' ' ' LEU . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.633 ' O ' HD13 ' A' ' 117' ' ' LEU . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.64 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.775 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.69 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.612 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.469 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.69 ' CA ' HD11 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.67 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.691 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.841 HG22 ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.804 0.335 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.39 126.02 53.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 4.6 tppt? -138.41 142.86 39.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.966 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.7 mm -65.75 154.75 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.827 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.532 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -112.39 -112.77 0.33 Allowed 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.739 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.715 ' HB2' HG23 ' B' ' 131' ' ' ILE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.841 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.478 ' HE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 -137.38 30.34 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.535 ' HG2' HG11 ' A' ' 160' ' ' VAL . 10.6 mttt -127.54 -58.65 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.923 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.37 156.98 35.15 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.028 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.44 117.71 3.46 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.423 2.082 . . . . 0.0 112.351 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 6.0 t -95.76 133.27 40.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.2 mp -141.13 158.48 43.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.93 30.95 4.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.78 98.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.866 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.8 -29.96 3.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.51 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 23.8 mtt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.841 -179.981 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.807 0.337 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.63 166.7 22.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 113.26 27.13 3.76 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.546 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -132.88 126.92 33.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.809 0.338 . . . . 0.0 110.856 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t 62.09 151.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.545 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.804 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 96' ' ' GLU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.422 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.831 HG23 ' HB3' ' A' ' 116' ' ' GLU . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.661 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.831 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.843 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.527 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.674 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 1.063 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.611 HG23 ' HB3' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.482 ' C ' HD13 ' A' ' 128' ' ' ILE . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.917 ' O ' HG23 ' A' ' 129' ' ' THR . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.803 ' H ' HD13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.917 HG23 ' O ' ' A' ' 127' ' ' THR . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 133' ' ' ILE . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.513 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 1.063 HD11 HD11 ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.484 ' HG3' HD11 ' A' ' 114' ' ' LEU . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 117' ' ' LEU . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.492 ' SD ' HD23 ' A' ' 117' ' ' LEU . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.694 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.694 ' N ' HD13 ' A' ' 148' ' ' ILE . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.477 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.804 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.697 ' HA ' HD22 ' A' ' 97' ' ' LEU . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.658 ' CE1' HD11 ' B' ' 131' ' ' ILE . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.713 ' CG ' HD21 ' A' ' 97' ' ' LEU . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.42 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.84 HG22 ' HG3' ' B' ' 135' ' ' ARG . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.756 0.312 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.2 117.4 8.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.894 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -129.54 -50.14 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.658 HD11 ' CE1' ' A' ' 156' ' ' PHE . 4.8 mm -59.25 154.86 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.999 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.492 ' HD2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -133.29 -110.16 0.23 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.074 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.573 HD12 ' C ' ' B' ' 133' ' ' ASP . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.84 ' HG3' HG22 ' A' ' 160' ' ' VAL . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.634 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.604 ' CB ' HG21 ' A' ' 160' ' ' VAL . 1.5 m-85 -73.15 57.4 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -118.49 -31.85 4.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.922 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.41 ' HB2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -149.23 157.44 39.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.794 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' B' ' 140' ' ' ARG . 73.5 Cg_endo -76.68 89.89 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.359 2.04 . . . . 0.0 112.394 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 4.0 p -149.62 100.33 2.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.864 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 33.5 mt -111.66 -33.77 6.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -95.01 44.52 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -141.25 120.35 12.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.63 157.88 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.538 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.3 mtm-85 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.885 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 30.8 mtt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.818 0.342 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -117.92 -173.86 2.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -159.79 135.55 4.17 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -136.21 -65.47 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.869 0.366 . . . . 0.0 110.922 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -64.91 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 157' ' ' MET . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.574 HD12 ' SD ' ' A' ' 157' ' ' MET . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.454 ' CE1' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.417 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.413 ' HG ' HG22 ' A' ' 133' ' ' ILE . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.75 ' CB ' HG23 ' A' ' 112' ' ' ILE . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.548 HD21 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.523 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.454 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.923 HD12 HD11 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.499 ' OG1' HD23 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.751 ' O ' HG23 ' A' ' 128' ' ' ILE . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.751 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.412 ' H ' HD11 ' A' ' 121' ' ' LEU . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.595 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.923 HD11 HD12 ' A' ' 121' ' ' LEU . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.548 ' N ' HD21 ' A' ' 117' ' ' LEU . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.859 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.859 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.716 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.842 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.716 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.844 ' HG3' HD21 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.687 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.806 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -154.12 147.18 24.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.49 164.73 11.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.749 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -72.65 154.3 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.858 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.548 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -114.58 -109.68 0.36 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.624 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.749 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.687 ' HA ' HG22 ' A' ' 160' ' ' VAL . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.47 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.7 OUTLIER -128.88 29.01 5.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -113.4 -44.5 3.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.81 156.42 29.8 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.966 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.16 -43.63 0.14 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.455 2.103 . . . . 0.0 112.44 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 9.1 t -138.05 177.16 8.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.31 -52.93 59.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.827 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 21.4 ttp85 63.47 124.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -123.89 133.4 53.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.39 -35.07 8.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.481 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.845 0.355 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.22 81.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.38 135.85 13.65 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.5 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.63 31.56 21.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m -122.47 32.0 5.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.492 ' HG3' HD13 ' A' ' 154' ' ' LEU . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.879 HD22 ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.48 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.785 ' CD1' HD23 ' A' ' 97' ' ' LEU . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.449 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.479 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' CB ' ' A' ' 116' ' ' GLU . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.701 HD23 ' HG3' ' A' ' 134' ' ' GLU . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.556 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.601 HD11 ' HB2' ' A' ' 137' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.529 HD12 ' CA ' ' A' ' 116' ' ' GLU . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.518 ' SD ' HD21 ' A' ' 136' ' ' LEU . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.772 HG23 ' H ' ' A' ' 126' ' ' GLU . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.772 ' H ' HG23 ' A' ' 124' ' ' THR . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.491 HD11 HD13 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.473 ' CB ' HD12 ' A' ' 128' ' ' ILE . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.493 ' CD1' HD13 ' A' ' 121' ' ' LEU . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.701 ' HG3' HD23 ' A' ' 114' ' ' LEU . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.518 HD21 ' SD ' ' A' ' 120' ' ' MET . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.601 ' HB2' HD11 ' A' ' 117' ' ' LEU . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.429 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.832 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.751 ' N ' HD13 ' A' ' 148' ' ' ILE . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.48 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.615 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.879 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.671 ' HA ' HD13 ' A' ' 97' ' ' LEU . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.464 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.762 ' HG3' HD21 ' A' ' 97' ' ' LEU . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.763 HG22 ' HG3' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 60.87 111.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -101.74 -44.42 5.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' B' ' 131' ' ' ILE . 7.8 mm -87.55 140.48 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.022 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -144.03 -112.89 0.1 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.799 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.763 ' HG3' HG22 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -44.78 -27.84 0.56 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.54 ' HG2' HG12 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -92.26 -177.27 4.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.938 0.399 . . . . 0.0 111.01 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -158.2 127.73 3.23 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.587 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 31.6 Cg_exo -59.17 -165.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.538 2.159 . . . . 0.0 112.401 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 142' ' ' THR . 8.2 m -158.41 31.23 0.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.836 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.2 mt 61.27 161.65 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.824 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.85 -67.59 0.21 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.994 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -118.82 102.19 8.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.941 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -50.35 -35.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.4 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.927 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.6 mtm . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.811 0.338 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -148.65 -59.59 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 153.53 147.83 4.74 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.78 30.36 19.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p -84.39 -36.18 22.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.639 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 100' ' ' LEU . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.449 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.629 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.867 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.629 ' CB ' HG23 ' A' ' 112' ' ' ILE . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.752 ' HA ' HD12 ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.603 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.679 HD13 ' HG1' ' A' ' 124' ' ' THR . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' B' ' 132' ' ' PHE . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.751 HG21 HD11 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.554 HG23 HG12 ' A' ' 128' ' ' ILE . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.751 HD11 HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.48 HG22 HD11 ' A' ' 121' ' ' LEU . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.666 ' CB ' HD12 ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.867 ' HG2' HD21 ' A' ' 114' ' ' LEU . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.805 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.454 ' HB2' HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.416 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.684 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.547 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.518 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.48 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.684 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.633 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.805 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.639 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.912 HG22 ' HA ' ' B' ' 135' ' ' ARG . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.815 0.34 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 63.01 143.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.38 -51.74 9.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.804 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.76 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.9 mm -59.61 155.06 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.852 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.724 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -116.66 -111.52 0.35 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.534 -179.742 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.76 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.912 ' HA ' HG22 ' A' ' 160' ' ' VAL . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.708 ' HB3' HG21 ' A' ' 160' ' ' VAL . 9.3 m-85 -133.62 -45.12 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.439 ' HB3' HG11 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -75.6 100.24 4.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.912 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.1 OUTLIER -74.03 126.95 88.85 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.479 ' O ' HG23 ' B' ' 142' ' ' THR . 23.6 Cg_exo -64.05 -65.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.511 2.141 . . . . 0.0 112.224 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.479 HG23 ' O ' ' B' ' 141' ' ' PRO . 0.7 OUTLIER -161.24 -176.31 5.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mp -87.09 135.4 33.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.893 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -128.22 153.36 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 60.04 178.54 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.701 ' O ' HG13 ' B' ' 146' ' ' VAL . 0.3 OUTLIER 49.3 23.91 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.949 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.84 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -155.27 120.59 4.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -84.99 0.14 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.608 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt 62.1 147.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m 59.58 161.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.709 HD13 ' HE2' ' B' ' 138' ' ' PHE . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.577 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.726 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.784 HD23 ' CG2' ' A' ' 133' ' ' ILE . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.577 ' CB ' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.726 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' CD2' ' B' ' 134' ' ' LEU . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.82 HD21 ' CG1' ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.606 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.634 ' C ' HD13 ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 128' ' ' ILE . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.82 ' CG1' HD21 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.431 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.784 ' CG2' HD23 ' A' ' 114' ' ' LEU . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.768 ' HG3' HD21 ' A' ' 114' ' ' LEU . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.52 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.405 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.733 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.692 ' N ' HD13 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.583 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.512 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.733 ' N ' HD11 ' A' ' 148' ' ' ILE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.52 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HG3' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 128' ' ' THR . . . . . 0.486 HG22 ' H ' ' B' ' 129' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.786 0.327 . . . . 0.0 111.206 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.486 ' H ' HG22 ' B' ' 128' ' ' THR . 17.3 mt-30 -153.2 84.72 1.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.979 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -58.34 -23.63 57.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.935 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.454 HD13 ' HA ' ' B' ' 131' ' ' ILE . 8.2 mm -80.7 157.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.649 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.565 ' CE2' HG21 ' A' ' 124' ' ' THR . 41.6 p90 -179.56 121.71 0.07 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.512 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' A' ' 160' ' ' VAL . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.592 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.709 ' HE2' HD13 ' A' ' 100' ' ' LEU . 3.3 m-85 -75.05 59.0 0.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.35 -175.73 5.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.865 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.22 165.95 27.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.21 129.14 12.77 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.609 2.206 . . . . 0.0 112.184 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 34.1 p -132.02 -79.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.41 -49.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.862 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.24 -68.52 0.17 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.6 mtm-85 -82.29 101.33 10.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.799 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -140.97 -170.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.845 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.943 179.843 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -77.62 122.23 25.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.925 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 95.93 -156.16 21.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.51 -79.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -102.29 17.74 22.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.203 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 157' ' ' MET . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.764 HG23 ' HB2' ' A' ' 116' ' ' GLU . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.764 ' HB2' HG23 ' A' ' 112' ' ' ILE . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.788 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.411 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 1.003 HD21 HG22 ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.762 HG21 HD11 ' A' ' 128' ' ' ILE . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.879 ' O ' HG23 ' A' ' 129' ' ' THR . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.762 HD11 HG21 ' A' ' 124' ' ' THR . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' THR . . . . . 1.003 HG22 HD21 ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.442 ' HB3' HD12 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.788 HG23 ' HB3' ' A' ' 117' ' ' LEU . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.415 ' SD ' HD23 ' A' ' 117' ' ' LEU . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.756 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.756 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.481 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.594 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.466 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.607 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.796 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.862 0.363 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -175.56 104.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -89.21 -31.35 17.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.066 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 8.4 mm -97.24 137.47 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 111.559 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.463 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -146.74 -110.17 0.09 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.195 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HA ' HG22 ' A' ' 160' ' ' VAL . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.662 ' HB3' HG21 ' A' ' 160' ' ' VAL . 12.2 m-85 -144.02 36.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.01 141.53 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.959 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.07 156.83 9.57 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.161 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.48 113.91 2.94 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.529 2.153 . . . . 0.0 112.457 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.02 35.94 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.3 98.9 8.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.96 -40.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.48 153.08 44.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.75 -32.13 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.458 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 ptt-85 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.891 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.3 tpp . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.855 0.359 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.99 172.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -137.93 74.09 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.524 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 177.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.748 0.309 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.34 -68.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.952 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.732 HD13 HD22 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' B' ' 138' ' ' PHE . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.71 HG23 ' HB2' ' A' ' 116' ' ' GLU . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.604 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.71 ' HB2' HG23 ' A' ' 112' ' ' ILE . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.744 HD21 ' HB3' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.641 ' HG3' HD12 ' A' ' 121' ' ' LEU . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.965 HD22 HD13 ' A' ' 133' ' ' ILE . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 121' ' ' LEU . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.898 ' O ' HG23 ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.818 HG22 ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.818 ' CB ' HG22 ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.965 HD13 HD22 ' A' ' 121' ' ' LEU . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.821 HD21 HD21 ' B' ' 134' ' ' LEU . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.828 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.741 ' N ' HD13 ' A' ' 148' ' ' ILE . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.804 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.566 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.828 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.804 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.439 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.648 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.919 HG22 ' HA ' ' B' ' 135' ' ' ARG . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.876 0.37 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.0 -57.25 0.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -121.7 128.27 51.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.507 HG21 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 58.37 163.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -141.39 -116.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.821 HD21 HD21 ' A' ' 136' ' ' LEU . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.919 ' HA ' HG22 ' A' ' 160' ' ' VAL . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.806 ' CE1' HD13 ' A' ' 100' ' ' LEU . 14.1 m-85 -145.08 31.05 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -116.21 158.51 23.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.96 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.07 168.48 9.16 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -67.84 173.71 8.76 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.549 2.166 . . . . 0.0 112.214 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 11.9 p 55.33 102.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.118 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.3 mt -107.95 105.23 14.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 14.4 mtt85 60.61 90.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -165.78 -44.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.54 HG13 ' N ' ' B' ' 147' ' ' ARG . 0.4 OUTLIER 54.28 173.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.336 179.889 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.54 ' N ' HG13 ' B' ' 146' ' ' VAL . 23.7 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.862 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.788 0.328 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.05 131.84 1.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.856 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.63 -65.91 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -167.94 37.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.968 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m -74.22 -47.65 34.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 100' ' ' LEU . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 97' ' ' LEU . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.447 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 26.8 m120 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 116' ' ' GLU . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.571 ' O ' HD12 ' A' ' 119' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.809 HD23 ' HE1' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.638 ' HG2' HD11 ' A' ' 121' ' ' LEU . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.571 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.809 ' HE1' HD23 ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 122' ' ' GLN . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.731 ' N ' HD12 ' A' ' 121' ' ' LEU . 9.6 mm100 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.68 HG21 ' HB2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.494 HD12 ' CB ' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 132' ' ' ASP . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 129' ' ' THR . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.659 ' H ' HG23 ' A' ' 129' ' ' THR . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 136' ' ' LEU . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.477 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.411 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.695 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.829 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.835 ' CG ' HD11 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.678 HG13 ' HG3' ' B' ' 135' ' ' ARG . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.792 0.33 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -126.88 28.64 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.941 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt 59.02 34.85 23.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.699 HD12 ' HB2' ' B' ' 135' ' ' ARG . 9.3 mm -94.24 135.02 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.906 0.384 . . . . 0.0 111.215 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.68 ' HB2' HG21 ' A' ' 124' ' ' THR . 0.4 OUTLIER -150.33 -110.09 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.913 179.382 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.55 ' HB2' HG23 ' A' ' 124' ' ' THR . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 120' ' ' MET . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.699 ' HB2' HD12 ' B' ' 131' ' ' ILE . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.574 ' HE2' HD21 ' A' ' 100' ' ' LEU . 92.1 m-85 -134.54 28.4 3.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.629 ' HG2' HG11 ' A' ' 160' ' ' VAL . 0.1 OUTLIER -154.64 127.6 8.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.729 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.69 139.87 2.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.045 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -85.65 80.67 1.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.586 2.191 . . . . 0.0 112.423 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.09 142.78 51.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 27.9 mt -146.82 -47.33 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -128.53 146.29 50.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -129.25 128.97 44.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.62 164.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.44 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.89 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.777 0.323 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -61.16 -34.7 75.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.33 -126.57 2.12 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 mptt 60.26 103.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.824 0.345 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.97 9.61 7.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.431 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.668 HD12 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.441 ' O ' HD13 ' A' ' 119' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.618 HG23 ' CB ' ' A' ' 116' ' ' GLU . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.703 ' O ' HD23 ' A' ' 117' ' ' LEU . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 134' ' ' GLU . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.618 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.589 HD12 ' CA ' ' A' ' 116' ' ' GLU . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.733 ' SD ' HD21 ' B' ' 134' ' ' LEU . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 120' ' ' MET . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.421 ' O ' HD22 ' A' ' 121' ' ' LEU . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.668 HD12 HD21 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 132' ' ' ASP . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.655 ' HB3' HD13 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.642 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' A' ' 114' ' ' LEU . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.569 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.641 ' SD ' HD21 ' A' ' 117' ' ' LEU . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.403 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.724 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.724 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.609 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.609 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.569 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.772 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.795 HG22 ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.788 0.328 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.32 38.19 10.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.451 ' HB3' HD13 ' A' ' 136' ' ' LEU . 8.1 mtmm -114.65 -41.95 3.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mm -100.44 148.47 6.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -153.03 -97.91 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 179.437 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.733 HD21 ' SD ' ' A' ' 120' ' ' MET . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' B' ' 138' ' ' PHE . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.668 ' CE2' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -41.01 -34.86 0.46 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -86.0 148.08 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.26 132.73 6.81 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.726 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -57.16 -162.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.491 2.127 . . . . 0.0 112.29 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.584 ' OG1' HD12 ' B' ' 143' ' ' LEU . 16.8 p -95.7 -50.24 5.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.988 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.584 HD12 ' OG1' ' B' ' 142' ' ' THR . 1.7 mp -135.39 141.97 45.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -109.73 159.75 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 60.54 170.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.81 -48.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.825 0.345 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.25 83.41 6.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 136.78 102.67 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.549 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -161.07 118.84 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.827 0.346 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m -176.84 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 154' ' ' LEU . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.884 HD21 ' CG ' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.409 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.773 HD23 HD23 ' A' ' 97' ' ' LEU . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.474 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.821 HG23 ' HB3' ' A' ' 116' ' ' GLU . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.618 HD23 HG22 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.821 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.726 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 121' ' ' LEU . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.401 ' N ' HD13 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.533 ' CG2' HD22 ' A' ' 121' ' ' LEU . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.514 ' O ' HG23 ' A' ' 128' ' ' ILE . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.689 ' O ' HG23 ' A' ' 129' ' ' THR . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 121' ' ' LEU . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 127' ' ' THR . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.726 HG23 ' HB3' ' A' ' 117' ' ' LEU . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.521 HD21 ' CD2' ' B' ' 134' ' ' LEU . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.46 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.794 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.734 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.56 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.794 ' N ' HD11 ' A' ' 148' ' ' ILE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.778 ' HA ' HD13 ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.671 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.884 ' CG ' HD21 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.676 HG13 ' CG ' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.793 0.33 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -60.29 118.63 6.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -165.08 -43.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.427 HD13 ' HA ' ' B' ' 131' ' ' ILE . 8.1 mm -87.61 140.08 16.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.073 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -143.37 -111.67 0.11 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.669 179.662 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.671 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.676 ' CG ' HG13 ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 71.5 m-85 -146.24 30.6 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.54 ' HG3' HG11 ' A' ' 160' ' ' VAL . 2.4 mttt -95.81 -43.75 7.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.8 153.14 42.27 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.72 -34.11 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 5.2 m 63.68 140.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.895 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.44 164.12 15.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.955 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -144.94 31.36 1.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -72.89 -70.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.78 131.46 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.423 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.906 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.886 0.374 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.6 109.32 15.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.1 139.09 3.51 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.475 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.53 75.73 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.807 0.336 . . . . 0.0 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 67.71 -71.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.789 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.789 HD12 ' HA ' ' A' ' 97' ' ' LEU . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.412 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 116' ' ' GLU . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.942 HD13 HD12 ' A' ' 117' ' ' LEU . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.752 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.942 HD12 HD13 ' A' ' 114' ' ' LEU . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.518 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.528 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.526 HG21 HG21 ' A' ' 127' ' ' THR . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.583 ' O ' HD13 ' A' ' 128' ' ' ILE . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.724 HG22 HG22 ' A' ' 129' ' ' THR . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.724 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.437 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' A' ' 121' ' ' LEU . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.791 HD21 HD21 ' B' ' 134' ' ' LEU . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.414 ' HE1' ' HA2' ' A' ' 146' ' ' GLY . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.434 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.414 ' HA2' ' HE1' ' A' ' 137' ' ' MET . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.768 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.459 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.457 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.768 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.669 HD22 HD13 ' A' ' 97' ' ' LEU . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.512 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.643 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.816 HG21 ' HB2' ' B' ' 138' ' ' PHE . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.811 0.338 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -102.91 124.65 48.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 18.7 mtmm -146.21 -47.7 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.742 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.732 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.8 mm -71.09 154.38 7.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.761 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -110.62 -114.3 0.31 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.0 -179.431 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.791 HD21 HD21 ' A' ' 136' ' ' LEU . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.603 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.816 ' HB2' HG21 ' A' ' 160' ' ' VAL . 6.3 m-85 -72.07 61.25 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.553 ' HG2' HG11 ' A' ' 160' ' ' VAL . 0.5 OUTLIER -122.39 172.6 8.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.153 -179.406 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.419 ' HB2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -58.94 159.37 13.72 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.915 179.903 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' B' ' 140' ' ' ARG . 89.3 Cg_endo -79.52 -38.12 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.282 1.988 . . . . 0.0 112.506 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.0 m -105.01 149.38 25.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.962 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.8 mt -103.93 -32.66 9.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 62.62 -80.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.051 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.4 ptt85 -88.64 105.23 17.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.21 142.19 3.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.399 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.7 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.788 0.328 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -129.9 -52.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -150.89 -173.12 20.62 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.494 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -112.44 80.02 1.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.819 0.342 . . . . 0.0 110.864 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t -171.89 -47.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.873 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.827 HD21 ' HG3' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.951 HD13 ' HE1' ' A' ' 157' ' ' MET . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.554 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.52 ' HD2' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.44 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.807 HG22 HD12 ' A' ' 117' ' ' LEU . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.439 ' O ' HD13 ' A' ' 117' ' ' LEU . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.775 ' CB ' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.807 HD12 HG22 ' A' ' 112' ' ' ILE . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HA ' HD11 ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.64 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.464 ' CD2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.887 ' O ' HG23 ' A' ' 129' ' ' THR . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.887 HG23 ' O ' ' A' ' 127' ' ' THR . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.413 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.728 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.4 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.816 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.774 ' N ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.615 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.601 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.816 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.706 HD22 HD13 ' A' ' 97' ' ' LEU . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.951 ' HE1' HD13 ' A' ' 100' ' ' LEU . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.854 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.832 0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -101.43 -79.39 0.51 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.586 ' O ' HD13 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -119.11 -33.8 4.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.074 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.644 ' H ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -117.12 170.89 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 120.983 0.421 . . . . 0.0 111.246 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.947 ' O ' HD12 ' B' ' 134' ' ' LEU . 3.5 p90 -166.43 105.01 0.63 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.947 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.854 ' HG3' HG22 ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 -45.76 -54.74 7.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -28.45 67.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.405 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER 63.42 135.32 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.921 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.405 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 34.4 Cg_exo -57.92 -163.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.494 2.129 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 74.4 p -103.95 171.2 7.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.918 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -106.31 133.82 50.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 172.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 29.6 mtt-85 -155.1 95.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.9 149.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.482 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.5 mtt . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.836 0.35 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -93.1 89.97 6.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.871 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.64 104.51 0.22 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp -76.71 113.67 14.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t -166.74 -47.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.681 HD13 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.428 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.453 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.769 HG23 ' HB2' ' A' ' 116' ' ' GLU . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.635 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.769 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.766 HD11 ' SD ' ' A' ' 137' ' ' MET . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 116' ' ' GLU . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.528 HD13 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.528 ' CG2' HD13 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.466 ' N ' HG23 ' A' ' 124' ' ' THR . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 128' ' ' ILE . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.583 HG21 ' HB2' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.44 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.583 ' HB2' HG21 ' A' ' 128' ' ' ILE . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.413 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.672 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.766 ' SD ' HD11 ' A' ' 117' ' ' LEU . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.835 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.731 ' N ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.55 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.607 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 97' ' ' LEU . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.672 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.749 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.563 HG21 ' CB ' ' B' ' 138' ' ' PHE . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.3 p . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.94 119.71 39.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.911 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 24.4 mtmt 60.51 -178.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.977 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.759 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -56.77 154.61 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -115.71 -109.18 0.36 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.534 -179.8 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.759 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.515 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.681 ' CE1' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -56.25 -30.84 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.01 176.08 5.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.942 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -173.82 132.84 0.57 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.751 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 44.7 Cg_exo -56.77 143.26 91.03 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.463 2.108 . . . . 0.0 112.342 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -93.45 125.63 38.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.6 mt -141.74 179.78 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.86 83.46 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -156.98 -44.94 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -46.53 -29.41 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.6 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.983 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.864 0.364 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.54 147.36 39.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.903 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.78 157.07 7.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.52 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -70.29 135.4 48.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.847 0.356 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 97' ' ' LEU . 47.2 t -176.6 -48.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.402 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.697 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.779 ' O ' HD23 ' A' ' 117' ' ' LEU . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.697 ' CB ' HG23 ' A' ' 112' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.871 ' CB ' HG23 ' A' ' 133' ' ' ILE . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HA ' HD11 ' A' ' 133' ' ' ILE . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.456 ' HB2' HD21 ' B' ' 134' ' ' LEU . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.749 HD13 HG13 ' A' ' 133' ' ' ILE . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' HD2' ' B' ' 132' ' ' PHE . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.537 ' O ' HG22 ' A' ' 127' ' ' THR . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.636 HD12 ' CD2' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.485 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.702 ' HB3' HD21 ' A' ' 121' ' ' LEU . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.871 HG23 ' CB ' ' A' ' 117' ' ' LEU . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.819 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.664 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.648 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.653 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.819 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.681 HD22 HD13 ' A' ' 97' ' ' LEU . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.751 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.798 0.333 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -157.61 161.48 38.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -94.16 150.37 20.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 57.57 165.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -146.68 -117.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.04 -179.626 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.816 ' C ' HD12 ' B' ' 134' ' ' LEU . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.816 HD12 ' C ' ' B' ' 133' ' ' ASP . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.892 ' HA ' HG22 ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.769 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.3 OUTLIER -124.73 26.54 7.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -99.73 -61.22 1.4 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.964 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.459 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 7.8 tpt180 -155.54 131.78 5.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 14.8 Cg_exo -68.49 -167.14 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.49 2.127 . . . . 0.0 112.25 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.65 163.17 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.086 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 29.4 mt -113.42 -36.36 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.85 98.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 48.7 mtt85 58.98 32.33 22.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.416 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.6 t 60.9 156.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.909 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.416 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 10.2 ttm180 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.815 0.341 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.32 113.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.83 131.47 1.91 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.525 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.26 31.57 20.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.29 -44.56 0.93 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.865 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 97' ' ' LEU . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.933 ' HA ' HD13 ' A' ' 119' ' ' ILE . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.804 HG23 ' HB3' ' A' ' 116' ' ' GLU . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.629 ' O ' HD12 ' A' ' 117' ' ' LEU . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.426 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.804 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.933 HD13 ' HA ' ' A' ' 104' ' ' PHE . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.446 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.693 HD11 HD11 ' A' ' 133' ' ' ILE . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.828 ' HB1' ' HB2' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.883 HG22 ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' HD13 ' A' ' 128' ' ' ILE . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.479 HD13 ' O ' ' A' ' 127' ' ' THR . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.434 ' OD1' HD12 ' A' ' 128' ' ' ILE . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.72 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.668 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.728 ' N ' HD13 ' A' ' 148' ' ' ILE . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.702 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.865 HD22 HD13 ' A' ' 97' ' ' LEU . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.808 ' SD ' HD11 ' A' ' 97' ' ' LEU . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.41 ' N ' ' HG3' ' A' ' 157' ' ' MET . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' B' ' 135' ' ' ARG . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -110.97 -29.7 7.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.972 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.18 135.86 36.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.825 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -69.31 150.16 10.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.667 179.82 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.883 ' CD1' HG22 ' A' ' 124' ' ' THR . 0.3 OUTLIER -117.31 -108.28 0.37 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.744 -179.416 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.828 ' HB2' ' HB1' ' A' ' 123' ' ' ALA . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.825 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HB2' HG21 ' B' ' 131' ' ' ILE . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 -44.31 -30.28 0.79 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 136' ' ' GLY . 0.0 OUTLIER -97.18 150.92 20.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.896 179.829 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.9 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -88.2 106.02 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.775 2.317 . . . . 0.0 112.502 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 32.2 p -68.18 -172.58 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.1 mp -130.05 178.58 6.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.835 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.85 103.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 60.67 81.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.33 -170.22 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.934 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 ptm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.865 0.364 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -123.92 147.2 47.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.92 110.58 3.57 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.498 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 30.92 3.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.44 -43.78 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.913 HD13 ' HA ' ' A' ' 154' ' ' LEU . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.797 HD12 HD23 ' A' ' 97' ' ' LEU . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.805 ' HA ' HD13 ' A' ' 119' ' ' ILE . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.677 HG23 ' CB ' ' A' ' 116' ' ' GLU . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.417 HD21 ' CG ' ' A' ' 134' ' ' GLU . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.677 ' CB ' HG23 ' A' ' 112' ' ' ILE . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.437 ' HA ' HD12 ' A' ' 133' ' ' ILE . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 104' ' ' PHE . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.892 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 132' ' ' ASP . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.664 ' HB3' ' CD1' ' B' ' 134' ' ' LEU . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.724 HG23 HD13 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.649 HG22 HG22 ' A' ' 129' ' ' THR . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 128' ' ' ILE . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.61 ' HB3' HD21 ' A' ' 121' ' ' LEU . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 117' ' ' LEU . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.417 ' CG ' HD21 ' A' ' 114' ' ' LEU . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.548 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.447 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.811 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.811 ' N ' HD13 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.407 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.696 ' N ' HD11 ' A' ' 148' ' ' ILE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.913 ' HA ' HD13 ' A' ' 97' ' ' LEU . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.472 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.548 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.788 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.94 HG22 ' HG3' ' B' ' 135' ' ' ARG . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.77 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -152.18 116.45 4.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.16 88.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.606 HG23 ' N ' ' B' ' 132' ' ' PHE . 0.0 OUTLIER 53.86 175.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.335 179.866 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.688 ' CD1' HD22 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -143.91 -144.94 0.16 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.791 -179.876 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.724 HD13 HG23 ' A' ' 124' ' ' THR . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.94 ' HG3' HG22 ' A' ' 160' ' ' VAL . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 136' ' ' GLY . . . . . 0.425 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 -118.36 21.99 12.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 139' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 160' ' ' VAL . 0.0 OUTLIER -150.9 155.94 40.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.673 179.887 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.42 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -178.94 132.88 0.28 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.745 179.967 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.42 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 98.5 Cg_endo -88.56 -21.38 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.827 2.351 . . . . 0.0 112.915 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.38 -69.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.999 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -138.94 177.76 7.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -167.79 113.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 43.44 67.16 0.68 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.465 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -47.21 -29.17 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.54 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.941 179.995 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 17.5 ttt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.876 0.37 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -130.12 88.67 2.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.45 85.14 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.492 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.28 100.12 5.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 110.913 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m -149.26 -53.72 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.851 HD11 ' CG ' ' A' ' 157' ' ' MET . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.431 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.659 HD12 HD23 ' A' ' 97' ' ' LEU . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.407 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 116' ' ' GLU . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 117' ' ' LEU . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.75 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 133' ' ' ILE . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.7 ' HB3' HD21 ' B' ' 134' ' ' LEU . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.577 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.493 HG21 HG22 ' A' ' 127' ' ' THR . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.436 ' N ' HG23 ' A' ' 124' ' ' THR . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 124' ' ' THR . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.619 HG21 ' CG ' ' A' ' 132' ' ' ASP . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.52 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.468 ' HB2' HG23 ' A' ' 129' ' ' THR . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.619 ' CG ' HG21 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.654 ' O ' HD13 ' A' ' 117' ' ' LEU . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.53 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.623 ' HB2' HD11 ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.431 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.87 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.87 ' N ' HD13 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.433 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.785 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.772 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.414 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.53 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.851 ' CG ' HD11 ' A' ' 97' ' ' LEU . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG13 ' HG2' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.788 0.328 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.14 -49.67 4.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.932 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.482 ' O ' ' O ' ' B' ' 131' ' ' ILE . 0.0 OUTLIER 61.42 -175.73 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.954 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.904 HD12 ' HB2' ' B' ' 135' ' ' ARG . 14.3 mm 54.01 141.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 179.225 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.732 ' O ' HD12 ' B' ' 134' ' ' LEU . 34.8 p90 177.85 112.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.968 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.732 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.904 ' HB2' HD12 ' B' ' 131' ' ' ILE . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 -140.34 36.4 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -113.38 -37.17 4.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.088 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 157.19 72.94 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.009 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.51 135.39 9.25 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.507 2.138 . . . . 0.0 112.434 -180.0 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 t -73.42 152.97 40.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.3 mt -60.05 156.38 15.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.3 mtt180 60.9 157.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.882 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.25 -38.24 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.957 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.19 162.02 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.501 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.923 179.988 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.796 0.331 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -88.71 -34.84 17.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -114.15 57.54 0.46 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.507 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.9 161.59 21.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.793 0.33 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.436 ' O ' HD12 ' A' ' 97' ' ' LEU . 0.3 OUTLIER -84.67 -30.92 24.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HG2' ' A' ' 157' ' ' MET . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.9 HD13 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.447 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.676 ' CD2' HD13 ' A' ' 112' ' ' ILE . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.816 HG23 ' HB3' ' A' ' 116' ' ' GLU . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.404 ' O ' HD23 ' A' ' 117' ' ' LEU . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 137' ' ' MET . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.816 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.777 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.495 HD12 ' CA ' ' A' ' 116' ' ' GLU . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.554 ' SD ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.928 HD12 HD11 ' A' ' 133' ' ' ILE . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.452 HG21 HG22 ' A' ' 127' ' ' THR . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.909 HG23 HG12 ' A' ' 128' ' ' ILE . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.909 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.847 ' HA ' HD11 ' A' ' 121' ' ' LEU . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.844 ' HB2' HD12 ' A' ' 128' ' ' ILE . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.928 HD11 HD12 ' A' ' 121' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.58 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 114' ' ' LEU . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.734 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.662 ' N ' HD13 ' A' ' 148' ' ' ILE . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.537 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.646 ' C ' HD11 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.734 ' N ' HD11 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.537 HD22 HD13 ' A' ' 97' ' ' LEU . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.58 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.935 HG22 ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.805 0.336 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.47 69.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.41 102.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.657 HG23 HD13 ' B' ' 134' ' ' LEU . 1.7 mm -73.96 142.33 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.17 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.665 ' CE1' HD11 ' B' ' 134' ' ' LEU . 16.8 p90 -102.35 -140.94 0.35 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.965 179.867 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.665 HD11 ' CE1' ' B' ' 132' ' ' PHE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.935 ' HA ' HG22 ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 100' ' ' LEU . 32.8 m-85 -151.14 28.44 0.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.45 173.81 7.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.159 -179.74 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.2 OUTLIER -155.91 114.62 2.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.603 179.917 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 3.6 Cg_exo -74.7 -71.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.81 2.34 . . . . 0.0 112.497 -179.533 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.613 HG22 ' O ' ' B' ' 142' ' ' THR . 47.4 m 55.66 26.7 9.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 7.3 mt -148.38 152.08 36.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.757 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.73 124.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.597 ' C ' HG23 ' B' ' 146' ' ' VAL . 0.3 OUTLIER 58.66 -174.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.074 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.597 HG23 ' C ' ' B' ' 145' ' ' ARG . 0.2 OUTLIER 63.68 -71.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.198 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 147' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' B' ' 145' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.045 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.849 0.357 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -84.14 105.8 15.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 92.45 65.32 1.11 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.452 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.52 148.85 48.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.794 0.331 . . . . 0.0 110.821 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.92 -61.22 0.5 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.066 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.493 ' CG ' HD13 ' A' ' 154' ' ' LEU . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.932 HD23 HD12 ' A' ' 100' ' ' LEU . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.932 HD12 HD23 ' A' ' 97' ' ' LEU . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.649 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.457 ' O ' HD13 ' A' ' 117' ' ' LEU . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.649 ' CB ' HG23 ' A' ' 112' ' ' ILE . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.812 ' HB3' HG23 ' A' ' 133' ' ' ILE . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.674 HD11 ' CG1' ' A' ' 128' ' ' ILE . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.489 HG21 ' CE2' ' B' ' 132' ' ' PHE . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.678 ' CG ' HD12 ' A' ' 128' ' ' ILE . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.678 HD12 ' CG ' ' A' ' 126' ' ' GLU . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.812 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.457 ' HG3' HD23 ' A' ' 114' ' ' LEU . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.523 HD21 ' CD2' ' B' ' 134' ' ' LEU . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.414 ' CA ' HD21 ' A' ' 117' ' ' LEU . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.836 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.736 ' CE1' HD21 ' A' ' 154' ' ' LEU . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.651 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.736 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.458 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.663 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.824 ' HG3' HD21 ' A' ' 97' ' ' LEU . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 157' ' ' MET . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.825 0.345 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 60.54 160.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -34.35 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.6 HD12 ' HB2' ' B' ' 135' ' ' ARG . 6.3 mm -102.61 134.47 43.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.386 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.2 OUTLIER -151.18 -93.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.919 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 133' ' ' ASP . . . . . 0.422 ' C ' HD12 ' B' ' 134' ' ' LEU . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.663 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.65 ' HG3' HG13 ' A' ' 160' ' ' VAL . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 -137.04 31.15 2.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -100.26 -167.66 1.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.875 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.81 157.68 41.1 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.852 179.831 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.6 105.84 2.1 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.259 1.973 . . . . 0.0 112.438 -179.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 57.9 p -76.04 -50.94 13.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 16.2 mt -147.6 -70.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 61.23 85.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -91.09 -43.66 9.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.99 -169.05 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.87 -179.934 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.893 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.6 ttt . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.83 0.348 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.36 81.7 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 88.62 109.6 1.1 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.51 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -51.04 43.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.793 0.33 . . . . 0.0 110.867 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.01 38.72 13.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.943 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' A' ' 100' ' ' LEU . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.408 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.796 ' HD3' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 116' ' ' GLU . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 134' ' ' GLU . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.844 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.686 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.796 HD11 ' HD3' ' A' ' 106' ' ' LYS . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.686 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.529 HD22 HD11 ' A' ' 133' ' ' ILE . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 121' ' ' LEU . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.771 HD12 ' HB3' ' A' ' 132' ' ' ASP . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.771 ' HB3' HD12 ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.765 HG12 HD11 ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' A' ' 114' ' ' LEU . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.444 ' HG3' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.439 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.407 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.87 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.778 ' N ' HD13 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.668 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.514 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.87 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.727 HD22 HD13 ' A' ' 97' ' ' LEU . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.599 ' HG2' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.527 HG22 ' HA ' ' B' ' 135' ' ' ARG . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.771 0.319 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.34 117.25 22.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -32.52 7.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.711 HD12 ' HB2' ' B' ' 135' ' ' ARG . 16.8 mm -94.52 134.01 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.0 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.763 ' H ' HD12 ' B' ' 134' ' ' LEU . 43.9 p90 -179.01 115.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.881 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.763 HD12 ' H ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.711 ' HB2' HD12 ' B' ' 131' ' ' ILE . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 160' ' ' VAL . 1.9 m-85 -107.67 29.2 7.43 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -104.37 -167.47 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.448 ' HG3' ' HD2' ' B' ' 141' ' ' PRO . 13.1 tpt180 -108.25 140.83 22.1 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.448 ' HD2' ' HG3' ' B' ' 140' ' ' ARG . 46.6 Cg_exo -57.01 -16.5 21.02 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.626 2.217 . . . . 0.0 113.088 -179.6 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 p -46.52 98.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.375 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 143' ' ' LEU . 11.6 mt 60.85 156.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.952 179.912 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.57 -45.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -90.6 115.0 27.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 t -76.46 149.65 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.927 179.729 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 tmm? . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.818 0.342 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -137.37 101.13 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -156.65 145.33 11.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -145.23 145.71 31.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.791 0.329 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.45 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.77 ' CD ' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.693 HG23 ' HB2' ' A' ' 116' ' ' GLU . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.517 HD21 ' HG3' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.693 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.696 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.534 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.77 HD11 ' CD ' ' A' ' 106' ' ' LYS . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.935 HD13 HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.935 HG23 HD13 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.623 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.63 ' O ' HG22 ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.753 ' O ' HG23 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.696 HG23 ' HB3' ' A' ' 117' ' ' LEU . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' HD21 ' A' ' 114' ' ' LEU . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.445 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.453 ' HA ' HD11 ' A' ' 117' ' ' LEU . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.81 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.74 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.923 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.596 ' C ' HD11 ' A' ' 148' ' ' ILE . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.923 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.445 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.659 ' HG3' HD21 ' A' ' 97' ' ' LEU . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.78 0.324 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -134.22 -75.04 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -49.55 2.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.69 HD13 ' HD3' ' B' ' 135' ' ' ARG . 0.0 OUTLIER -130.12 166.85 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.122 179.85 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -145.64 -94.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.408 -179.673 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.446 ' HB2' ' CG2' ' B' ' 131' ' ' ILE . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.83 -27.24 4.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -54.77 -177.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.059 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -96.04 139.74 21.94 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.036 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.53 -167.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.449 2.1 . . . . 0.0 112.2 179.993 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.3 m -162.01 113.19 1.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mt -113.56 -60.82 1.83 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.86 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -146.6 152.97 39.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.24 88.1 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.21 141.26 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.521 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.884 179.993 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.7 mtm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 -47.0 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.912 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.77 -179.28 1.75 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -121.86 164.82 16.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 0.0 110.878 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t -176.99 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.615 HD13 ' CE2' ' B' ' 138' ' ' PHE . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.791 HG23 ' HB3' ' A' ' 116' ' ' GLU . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.791 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.81 HD12 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.5 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.551 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.75 HD21 HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.766 ' O ' HD11 ' A' ' 128' ' ' ILE . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.657 ' O ' HD13 ' A' ' 128' ' ' ILE . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.432 ' O ' HG23 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.766 HD11 ' O ' ' A' ' 124' ' ' THR . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.713 HG22 ' HG ' ' A' ' 121' ' ' LEU . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.81 HG23 HD12 ' A' ' 117' ' ' LEU . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.54 HD21 ' HZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 147' ' ' ARG . . . . . 0.433 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.848 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.644 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.691 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.55 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.848 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 97' ' ' LEU . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.592 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.773 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.87 0.367 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -91.21 155.95 18.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -93.34 131.65 38.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.598 HD13 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 59.14 162.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.045 179.967 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.6 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.5 OUTLIER -144.84 -123.0 0.08 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.961 -179.875 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.615 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -56.87 -29.98 63.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.37 130.37 55.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 -179.915 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.406 ' HB2' ' CD ' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -77.57 171.65 11.89 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.937 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.406 ' CD ' ' HB2' ' B' ' 140' ' ' ARG . 25.1 Cg_exo -62.6 164.51 18.1 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.376 2.051 . . . . 0.0 112.269 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 82.5 p -148.4 -48.29 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.492 HD13 HG21 ' B' ' 146' ' ' VAL . 0.4 OUTLIER -84.37 -174.39 5.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.914 -179.923 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -118.62 -52.77 2.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 ptt-85 -133.79 108.95 8.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.956 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 146' ' ' VAL . . . . . 0.492 HG21 HD13 ' B' ' 143' ' ' LEU . 0.2 OUTLIER -122.47 -45.25 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.982 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.975 -179.863 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.802 0.335 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.74 178.41 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.57 -78.19 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt 60.67 77.77 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.877 0.37 . . . . 0.0 110.899 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.59 -43.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.786 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 116' ' ' GLU . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.588 ' H ' HD22 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' HD21 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 128' ' ' ILE . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.488 HG23 ' N ' ' A' ' 125' ' ' GLY . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.488 ' N ' HG23 ' A' ' 124' ' ' THR . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.487 HG22 ' N ' ' A' ' 128' ' ' ILE . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.521 HD13 ' CB ' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 133' ' ' ILE . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.521 ' CB ' HD13 ' A' ' 128' ' ' ILE . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.584 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.486 ' HG3' HD13 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.735 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.64 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.518 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.719 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.659 ' CB ' HD13 ' A' ' 97' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.584 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.665 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.623 HG22 ' HG3' ' B' ' 135' ' ' ARG . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.789 0.328 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -85.31 84.46 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 130' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' B' ' 131' ' ' ILE . 35.4 mtmt 60.99 -171.41 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.849 HD12 ' HB2' ' B' ' 135' ' ' ARG . 6.2 mm 54.12 135.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.411 0.624 . . . . 0.0 112.257 179.354 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.536 ' H ' HD12 ' B' ' 134' ' ' LEU . 34.4 p90 -179.47 114.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.632 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.536 HD12 ' H ' ' B' ' 132' ' ' PHE . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.849 ' HB2' HD12 ' B' ' 131' ' ' ILE . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.535 ' HE2' HD13 ' A' ' 100' ' ' LEU . 8.7 m-85 -130.76 24.7 5.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.49 -30.82 6.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.411 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.1 OUTLIER 63.29 136.38 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.735 -179.818 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 85.0 Cg_endo -88.19 160.96 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.727 2.285 . . . . 0.0 112.568 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.02 -65.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.9 mt -144.87 -54.33 0.31 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.948 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -68.27 176.04 2.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -136.89 -47.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.906 179.986 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.5 t -108.11 155.24 9.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.843 179.888 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.01 151.47 23.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.52 -119.93 1.67 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.527 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 60.63 32.14 20.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 110.934 -179.957 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t -132.53 -45.85 0.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.825 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.495 HD13 ' HE1' ' B' ' 138' ' ' PHE . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 116' ' ' GLU . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.752 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.528 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.803 HD13 ' OG1' ' A' ' 124' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.803 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.477 ' O ' HG23 ' A' ' 129' ' ' THR . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.729 HG13 HD11 ' A' ' 121' ' ' LEU . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.504 HG22 ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 117' ' ' LEU . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.604 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 148' ' ' ILE . . . . . 0.787 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 150' ' ' TYR . . . . . 0.964 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 152' ' ' GLU . . . . . 0.432 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 153' ' ' PHE . . . . . 0.825 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.964 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 160' ' ' VAL . . . . . 0.767 HG22 ' HG3' ' B' ' 135' ' ' ARG . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 128' ' ' THR . . . . . 0.456 HG22 ' CD1' ' B' ' 132' ' ' PHE . 1.2 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.819 0.342 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 68.5 -68.43 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.972 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -130.92 -43.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 131' ' ' ILE . . . . . 0.454 ' N ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -135.02 168.53 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.733 179.596 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 132' ' ' PHE . . . . . 0.63 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -146.83 -96.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.773 -179.347 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HG3' HG22 ' A' ' 160' ' ' VAL . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 138' ' ' PHE . . . . . 0.495 ' HE1' HD13 ' A' ' 100' ' ' LEU . 3.1 m-85 -110.65 30.68 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.99 159.25 44.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 140' ' ' ARG . . . . . 0.408 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER 62.91 133.46 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.728 -179.887 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 141' ' ' PRO . . . . . 0.408 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 52.8 Cg_exo -55.14 100.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.437 2.091 . . . . 0.0 112.235 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 142' ' ' THR . . . . . 0.408 ' O ' ' N ' ' B' ' 144' ' ' ARG . 0.7 OUTLIER -90.95 11.62 22.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.397 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 143' ' ' LEU . . . . . 0.511 HD22 ' HD3' ' B' ' 145' ' ' ARG . 23.5 mt 62.89 -77.15 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.116 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 144' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' B' ' 142' ' ' THR . 1.6 tpt180 68.22 41.19 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.855 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 145' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' B' ' 143' ' ' LEU . 0.6 OUTLIER -137.97 42.21 2.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 60.22 155.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.132 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.832 0.349 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.696 HD13 HD22 ' A' ' 154' ' ' LEU . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.494 HD12 ' HA ' ' A' ' 97' ' ' LEU . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.691 HG23 ' CB ' ' A' ' 116' ' ' GLU . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.847 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.691 ' CB ' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.589 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.594 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.515 ' HG3' HD12 ' A' ' 121' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.807 HD22 HG12 ' A' ' 133' ' ' ILE . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.792 HG21 HD11 ' A' ' 128' ' ' ILE . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.792 HD11 HG21 ' A' ' 124' ' ' THR . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.611 ' HA ' HD23 ' A' ' 121' ' ' LEU . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.807 HG12 HD22 ' A' ' 121' ' ' LEU . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.847 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.61 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.861 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.861 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.475 ' CE1' HD21 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.625 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.609 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 97' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.61 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.586 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.742 HG22 ' HA ' ' B' ' 135' ' ' ARG . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.475 ' O ' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.666 0.269 . . . . 0.0 110.956 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' ' 134' ' ' LEU . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.742 ' HA ' HG22 ' A' ' 160' ' ' VAL . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.491 ' HE1' HD13 ' A' ' 100' ' ' LEU . 6.3 m-85 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.809 0.337 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.654 HD13 ' HB3' ' A' ' 154' ' ' LEU . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.643 HD13 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.776 HG23 ' HB3' ' A' ' 116' ' ' GLU . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.504 ' HG ' HG22 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.776 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.69 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.539 ' HB2' HD21 ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 132' ' ' ASP . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.582 HG23 HD11 ' A' ' 128' ' ' ILE . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.881 HG12 HD23 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.52 ' HA ' HD22 ' A' ' 121' ' ' LEU . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.69 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 117' ' ' LEU . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.757 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.757 ' N ' HD13 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.678 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.458 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.551 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 97' ' ' LEU . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.914 HG22 ' HA ' ' B' ' 135' ' ' ARG . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 134' ' ' LEU . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.914 ' HA ' HG22 ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.835 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.798 HD21 ' CG ' ' A' ' 157' ' ' MET . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.568 HD23 HD23 ' A' ' 97' ' ' LEU . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.799 ' HA ' HD13 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.694 HG23 ' CB ' ' A' ' 116' ' ' GLU . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.694 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.906 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.799 HD13 ' HA ' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.602 ' HB2' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.746 HD11 ' HB3' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.459 HG13 HD23 ' A' ' 121' ' ' LEU . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.553 ' HA ' HD22 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.746 ' HB3' HD11 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.906 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.752 ' HG ' HD11 ' A' ' 117' ' ' LEU . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.486 ' SD ' HD23 ' A' ' 117' ' ' LEU . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.402 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.866 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.866 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.849 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.557 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.7 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.849 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.705 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.798 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.682 HG13 ' CG ' ' B' ' 135' ' ' ARG . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.963 ' O ' HD12 ' B' ' 134' ' ' LEU . 27.2 p90 . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.664 0.269 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.963 HD12 ' O ' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.682 ' CG ' HG13 ' A' ' 160' ' ' VAL . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.851 0.358 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.507 ' O ' HD13 ' A' ' 100' ' ' LEU . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.636 ' HA ' HD22 ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.469 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 116' ' ' GLU . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.763 HD23 HG23 ' A' ' 133' ' ' ILE . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.606 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.599 ' SD ' HD21 ' B' ' 134' ' ' LEU . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 1.061 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.402 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.71 HG22 HD12 ' A' ' 121' ' ' LEU . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 1.061 HD11 HD11 ' A' ' 121' ' ' LEU . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.474 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.403 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.824 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.643 ' N ' HD13 ' A' ' 148' ' ' ILE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.548 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.556 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.824 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.575 ' HA ' HD22 ' A' ' 97' ' ' LEU . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.638 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.699 ' O ' HG23 ' A' ' 160' ' ' VAL . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.857 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 111.071 0.026 . . . . 0.0 111.071 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.638 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.857 ' HG3' HG22 ' A' ' 160' ' ' VAL . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.478 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.573 ' CB ' HG21 ' A' ' 160' ' ' VAL . 5.3 m-85 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.759 0.314 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 154' ' ' LEU . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.635 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.407 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.431 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.756 HG23 ' CB ' ' A' ' 116' ' ' GLU . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.756 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.724 HD13 ' HE3' ' A' ' 137' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.563 HD12 ' O ' ' A' ' 116' ' ' GLU . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.467 ' HB2' HD21 ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.808 HD11 HG13 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.655 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.426 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.766 ' O ' HG23 ' A' ' 128' ' ' ILE . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.808 HG13 HD11 ' A' ' 121' ' ' LEU . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.76 HG23 HD12 ' A' ' 121' ' ' LEU . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.681 HG23 HD23 ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.724 ' HE3' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.401 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.4 m-20 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.828 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.828 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.822 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.553 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.751 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.822 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.718 ' SD ' HD11 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.863 HG22 ' HG3' ' B' ' 135' ' ' ARG . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.87 ' O ' HD12 ' B' ' 134' ' ' LEU . 32.6 p90 . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 120.805 0.335 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.87 HD12 ' O ' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.55 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.635 ' CE1' HD21 ' A' ' 100' ' ' LEU . 2.4 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.814 0.34 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.691 HD21 ' HG2' ' A' ' 157' ' ' MET . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 116' ' ' GLU . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.625 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 114' ' ' LEU . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.468 ' HG3' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.893 HD11 HG13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.742 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.893 HG13 HD11 ' A' ' 121' ' ' LEU . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.63 HG22 HD12 ' A' ' 121' ' ' LEU . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.633 ' O ' HD13 ' A' ' 117' ' ' LEU . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.64 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.775 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.69 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.612 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.469 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.69 ' CA ' HD11 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.67 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.691 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.841 HG22 ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.532 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.67 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.841 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.478 ' HE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.856 0.36 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.545 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.804 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 96' ' ' GLU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.422 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.831 HG23 ' HB3' ' A' ' 116' ' ' GLU . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.661 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.831 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.843 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.527 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.674 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 1.063 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.611 HG23 ' HB3' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.482 ' C ' HD13 ' A' ' 128' ' ' ILE . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.917 ' O ' HG23 ' A' ' 129' ' ' THR . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.803 ' H ' HD13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.917 HG23 ' O ' ' A' ' 127' ' ' THR . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 133' ' ' ILE . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.513 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 1.063 HD11 HD11 ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.484 ' HG3' HD11 ' A' ' 114' ' ' LEU . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 117' ' ' LEU . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.492 ' SD ' HD23 ' A' ' 117' ' ' LEU . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.694 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.694 ' N ' HD13 ' A' ' 148' ' ' ILE . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.477 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.804 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.697 ' HA ' HD22 ' A' ' 97' ' ' LEU . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.544 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.713 ' CG ' HD21 ' A' ' 97' ' ' LEU . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.42 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.84 HG22 ' HG3' ' B' ' 135' ' ' ARG . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.492 ' HD2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 119.97 -0.062 . . . . 0.0 111.074 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.573 HD12 ' C ' ' B' ' 133' ' ' ASP . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.84 ' HG3' HG22 ' A' ' 160' ' ' VAL . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.634 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.604 ' CB ' HG21 ' A' ' 160' ' ' VAL . 1.5 m-85 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.795 0.331 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 157' ' ' MET . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.574 HD12 ' SD ' ' A' ' 157' ' ' MET . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.454 ' CE1' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.417 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.413 ' HG ' HG22 ' A' ' 133' ' ' ILE . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.75 ' CB ' HG23 ' A' ' 112' ' ' ILE . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.548 HD21 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.523 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.454 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.923 HD12 HD11 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.499 ' OG1' HD23 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.751 ' O ' HG23 ' A' ' 128' ' ' ILE . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.751 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.412 ' H ' HD11 ' A' ' 121' ' ' LEU . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.595 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.923 HD11 HD12 ' A' ' 121' ' ' LEU . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.548 ' N ' HD21 ' A' ' 117' ' ' LEU . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.859 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.859 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.716 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.842 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.716 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.844 ' HG3' HD21 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.687 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.548 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.548 HD13 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.687 ' HA ' HG22 ' A' ' 160' ' ' VAL . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.47 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.838 0.352 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.492 ' HG3' HD13 ' A' ' 154' ' ' LEU . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.879 HD22 ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.48 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.785 ' CD1' HD23 ' A' ' 97' ' ' LEU . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.449 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.479 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' CB ' ' A' ' 116' ' ' GLU . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.701 HD23 ' HG3' ' A' ' 134' ' ' GLU . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.556 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.601 HD11 ' HB2' ' A' ' 137' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.529 HD12 ' CA ' ' A' ' 116' ' ' GLU . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.518 ' SD ' HD21 ' A' ' 136' ' ' LEU . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.772 HG23 ' H ' ' A' ' 126' ' ' GLU . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.772 ' H ' HG23 ' A' ' 124' ' ' THR . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.491 HD11 HD13 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.473 ' CB ' HD12 ' A' ' 128' ' ' ILE . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.493 ' CD1' HD13 ' A' ' 121' ' ' LEU . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.701 ' HG3' HD23 ' A' ' 114' ' ' LEU . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.518 HD21 ' SD ' ' A' ' 120' ' ' MET . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.601 ' HB2' HD11 ' A' ' 117' ' ' LEU . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.429 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.832 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.751 ' N ' HD13 ' A' ' 148' ' ' ILE . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.48 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.615 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.879 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.671 ' HA ' HD13 ' A' ' 97' ' ' LEU . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.464 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.762 ' HG3' HD21 ' A' ' 97' ' ' LEU . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.763 HG22 ' HG3' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 110.799 -0.074 . . . . 0.0 110.799 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.763 ' HG3' HG22 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 . . . . . 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.849 0.357 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.639 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 100' ' ' LEU . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.449 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.629 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.867 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.629 ' CB ' HG23 ' A' ' 112' ' ' ILE . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.752 ' HA ' HD12 ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.603 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.679 HD13 ' HG1' ' A' ' 124' ' ' THR . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' B' ' 132' ' ' PHE . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.751 HG21 HD11 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.554 HG23 HG12 ' A' ' 128' ' ' ILE . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.751 HD11 HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.48 HG22 HD11 ' A' ' 121' ' ' LEU . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.666 ' CB ' HD12 ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.867 ' HG2' HD21 ' A' ' 114' ' ' LEU . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.805 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.454 ' HB2' HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.416 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.684 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.547 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.518 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.48 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.684 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.633 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.805 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.639 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.912 HG22 ' HA ' ' B' ' 135' ' ' ARG . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.724 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.513 ' N ' HD12 ' B' ' 134' ' ' LEU . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.912 ' HA ' HG22 ' A' ' 160' ' ' VAL . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.708 ' HB3' HG21 ' A' ' 160' ' ' VAL . 9.3 m-85 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.796 0.331 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.709 HD13 ' HE2' ' B' ' 138' ' ' PHE . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.577 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.726 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.784 HD23 ' CG2' ' A' ' 133' ' ' ILE . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.577 ' CB ' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.726 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' CD2' ' B' ' 134' ' ' LEU . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.82 HD21 ' CG1' ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.606 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.634 ' C ' HD13 ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 128' ' ' ILE . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.82 ' CG1' HD21 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.431 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.784 ' CG2' HD23 ' A' ' 114' ' ' LEU . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.768 ' HG3' HD21 ' A' ' 114' ' ' LEU . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.52 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.405 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.733 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.692 ' N ' HD13 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.583 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.512 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.733 ' N ' HD11 ' A' ' 148' ' ' ILE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.52 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HG3' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.565 ' CE2' HG21 ' A' ' 124' ' ' THR . 41.6 p90 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 120' ' ' MET . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' A' ' 160' ' ' VAL . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.592 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.709 ' HE2' HD13 ' A' ' 100' ' ' LEU . 3.3 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.702 0.287 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 157' ' ' MET . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.764 HG23 ' HB2' ' A' ' 116' ' ' GLU . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.764 ' HB2' HG23 ' A' ' 112' ' ' ILE . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.788 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.411 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 1.003 HD21 HG22 ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.762 HG21 HD11 ' A' ' 128' ' ' ILE . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.879 ' O ' HG23 ' A' ' 129' ' ' THR . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.762 HD11 HG21 ' A' ' 124' ' ' THR . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 1.003 HG22 HD21 ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.442 ' HB3' HD12 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.788 HG23 ' HB3' ' A' ' 117' ' ' LEU . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.415 ' SD ' HD23 ' A' ' 117' ' ' LEU . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.756 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.756 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.481 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.594 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.466 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.607 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.796 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.463 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HA ' HG22 ' A' ' 160' ' ' VAL . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.662 ' HB3' HG21 ' A' ' 160' ' ' VAL . 12.2 m-85 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.828 0.347 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.732 HD13 HD22 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' B' ' 138' ' ' PHE . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.71 HG23 ' HB2' ' A' ' 116' ' ' GLU . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.604 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.71 ' HB2' HG23 ' A' ' 112' ' ' ILE . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.744 HD21 ' HB3' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.641 ' HG3' HD12 ' A' ' 121' ' ' LEU . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.965 HD22 HD13 ' A' ' 133' ' ' ILE . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 121' ' ' LEU . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.898 ' O ' HG23 ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.818 HG22 ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.818 ' CB ' HG22 ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.965 HD13 HD22 ' A' ' 121' ' ' LEU . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.821 HD21 HD21 ' B' ' 134' ' ' LEU . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.828 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.741 ' N ' HD13 ' A' ' 148' ' ' ILE . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.804 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.566 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.828 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.804 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.439 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.648 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.919 HG22 ' HA ' ' B' ' 135' ' ' ARG . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 110.677 -0.12 . . . . 0.0 110.677 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.821 HD21 HD21 ' A' ' 136' ' ' LEU . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.919 ' HA ' HG22 ' A' ' 160' ' ' VAL . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.806 ' CE1' HD13 ' A' ' 100' ' ' LEU . 14.1 m-85 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.821 0.344 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 100' ' ' LEU . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 97' ' ' LEU . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.447 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 116' ' ' GLU . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.571 ' O ' HD12 ' A' ' 119' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.809 HD23 ' HE1' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.638 ' HG2' HD11 ' A' ' 121' ' ' LEU . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.571 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.809 ' HE1' HD23 ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 122' ' ' GLN . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.731 ' N ' HD12 ' A' ' 121' ' ' LEU . 15.5 mm-40 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.68 HG21 ' HB2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.494 HD12 ' CB ' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 132' ' ' ASP . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 129' ' ' THR . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.659 ' H ' HG23 ' A' ' 129' ' ' THR . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 136' ' ' LEU . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.477 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.411 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.695 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.829 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.835 ' CG ' HD11 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.678 HG13 ' HG3' ' B' ' 135' ' ' ARG . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.68 ' HB2' HG21 ' A' ' 124' ' ' THR . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.913 -0.032 . . . . 0.0 110.913 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.55 ' HB2' HG23 ' A' ' 124' ' ' THR . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 120' ' ' MET . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.678 ' HG3' HG13 ' A' ' 160' ' ' VAL . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.574 ' HE2' HD21 ' A' ' 100' ' ' LEU . 92.1 m-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 120.582 0.23 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.668 HD12 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.441 ' O ' HD13 ' A' ' 119' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.618 HG23 ' CB ' ' A' ' 116' ' ' GLU . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.703 ' O ' HD23 ' A' ' 117' ' ' LEU . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 134' ' ' GLU . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.618 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.589 HD12 ' CA ' ' A' ' 116' ' ' GLU . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.733 ' SD ' HD21 ' B' ' 134' ' ' LEU . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 120' ' ' MET . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.421 ' O ' HD22 ' A' ' 121' ' ' LEU . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.668 HD12 HD21 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 132' ' ' ASP . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.655 ' HB3' HD13 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.642 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' A' ' 114' ' ' LEU . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.569 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.641 ' SD ' HD21 ' A' ' 117' ' ' LEU . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.403 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.724 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.724 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.609 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.609 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.569 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.772 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.795 HG22 ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-O 120.207 0.051 . . . . 0.0 111.005 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.733 HD21 ' SD ' ' A' ' 120' ' ' MET . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' B' ' 138' ' ' PHE . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.668 ' CE2' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.816 0.341 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 154' ' ' LEU . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.884 HD21 ' CG ' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.409 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.773 HD23 HD23 ' A' ' 97' ' ' LEU . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.474 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.821 HG23 ' HB3' ' A' ' 116' ' ' GLU . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.618 HD23 HG22 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.821 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.726 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 121' ' ' LEU . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.401 ' N ' HD13 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.533 ' CG2' HD22 ' A' ' 121' ' ' LEU . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.514 ' O ' HG23 ' A' ' 128' ' ' ILE . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.689 ' O ' HG23 ' A' ' 129' ' ' THR . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 121' ' ' LEU . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 127' ' ' THR . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.726 HG23 ' HB3' ' A' ' 117' ' ' LEU . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.521 HD21 ' CD2' ' B' ' 134' ' ' LEU . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.46 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.794 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.734 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.56 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.794 ' N ' HD11 ' A' ' 148' ' ' ILE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.778 ' HA ' HD13 ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.671 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.884 ' CG ' HD21 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.676 HG13 ' CG ' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 110.669 -0.123 . . . . 0.0 110.669 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.671 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.676 ' CG ' HG13 ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 71.5 m-85 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.75 0.309 . . . . 0.0 110.964 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.789 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.789 HD12 ' HA ' ' A' ' 97' ' ' LEU . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.412 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 116' ' ' GLU . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.942 HD13 HD12 ' A' ' 117' ' ' LEU . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.752 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.942 HD12 HD13 ' A' ' 114' ' ' LEU . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.518 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.528 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.526 HG21 HG21 ' A' ' 127' ' ' THR . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.583 ' O ' HD13 ' A' ' 128' ' ' ILE . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.724 HG22 HG22 ' A' ' 129' ' ' THR . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.724 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.437 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' A' ' 121' ' ' LEU . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.791 HD21 HD21 ' B' ' 134' ' ' LEU . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.414 ' HE1' ' HA2' ' A' ' 146' ' ' GLY . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.434 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.414 ' HA2' ' HE1' ' A' ' 137' ' ' MET . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.768 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.459 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.457 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.768 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.669 HD22 HD13 ' A' ' 97' ' ' LEU . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.512 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.643 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.816 HG21 ' HB2' ' B' ' 138' ' ' PHE . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.791 HD21 HD21 ' A' ' 136' ' ' LEU . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.603 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.816 ' HB2' HG21 ' A' ' 160' ' ' VAL . 6.3 m-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.782 0.325 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.827 HD21 ' HG3' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.951 HD13 ' HE1' ' A' ' 157' ' ' MET . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.554 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.52 ' HD2' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.44 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.807 HG22 HD12 ' A' ' 117' ' ' LEU . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.439 ' O ' HD13 ' A' ' 117' ' ' LEU . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.775 ' CB ' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.807 HD12 HG22 ' A' ' 112' ' ' ILE . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HA ' HD11 ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.64 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.464 ' CD2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.887 ' O ' HG23 ' A' ' 129' ' ' THR . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.887 HG23 ' O ' ' A' ' 127' ' ' THR . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.413 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.728 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.4 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.816 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.774 ' N ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.615 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.601 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.816 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.706 HD22 HD13 ' A' ' 97' ' ' LEU . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.951 ' HE1' HD13 ' A' ' 100' ' ' LEU . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.854 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.947 ' O ' HD12 ' B' ' 134' ' ' LEU . 3.5 p90 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.685 0.279 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.947 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.854 ' HG3' HG22 ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.827 0.346 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.681 HD13 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.428 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.453 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.769 HG23 ' HB2' ' A' ' 116' ' ' GLU . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.635 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.769 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.766 HD11 ' SD ' ' A' ' 137' ' ' MET . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 116' ' ' GLU . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.528 HD13 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.528 ' CG2' HD13 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.466 ' N ' HG23 ' A' ' 124' ' ' THR . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 128' ' ' ILE . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.583 HG21 ' HB2' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.44 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.583 ' HB2' HG21 ' A' ' 128' ' ' ILE . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.413 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.672 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.766 ' SD ' HD11 ' A' ' 117' ' ' LEU . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.835 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.731 ' N ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.55 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.607 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 97' ' ' LEU . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.672 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.749 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.563 HG21 ' CB ' ' B' ' 138' ' ' PHE . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 111.534 0.198 . . . . 0.0 111.534 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.531 HD13 ' CD2' ' B' ' 132' ' ' PHE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.515 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.681 ' CE1' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 97' ' ' LEU . 47.2 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.842 0.353 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.402 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.697 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.779 ' O ' HD23 ' A' ' 117' ' ' LEU . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.445 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.697 ' CB ' HG23 ' A' ' 112' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.871 ' CB ' HG23 ' A' ' 133' ' ' ILE . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HA ' HD11 ' A' ' 133' ' ' ILE . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.456 ' HB2' HD21 ' B' ' 134' ' ' LEU . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.749 HD13 HG13 ' A' ' 133' ' ' ILE . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' HD2' ' B' ' 132' ' ' PHE . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.537 ' O ' HG22 ' A' ' 127' ' ' THR . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.636 HD12 ' CD2' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.485 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.702 ' HB3' HD21 ' A' ' 121' ' ' LEU . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.871 HG23 ' CB ' ' A' ' 117' ' ' LEU . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.819 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.664 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.648 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.653 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.819 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.681 HD22 HD13 ' A' ' 97' ' ' LEU . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.751 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.7 OUTLIER . . . . . 0 CA--C 1.534 0.336 0 CA-C-O 119.945 -0.074 . . . . 0.0 111.04 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.816 ' C ' HD12 ' B' ' 134' ' ' LEU . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.816 HD12 ' C ' ' B' ' 133' ' ' ASP . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.892 ' HA ' HG22 ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.769 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.804 0.335 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.865 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 97' ' ' LEU . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.933 ' HA ' HD13 ' A' ' 119' ' ' ILE . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.804 HG23 ' HB3' ' A' ' 116' ' ' GLU . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.629 ' O ' HD12 ' A' ' 117' ' ' LEU . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.426 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.804 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.933 HD13 ' HA ' ' A' ' 104' ' ' PHE . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.446 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.693 HD11 HD11 ' A' ' 133' ' ' ILE . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.828 ' HB1' ' HB2' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.883 HG22 ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' HD13 ' A' ' 128' ' ' ILE . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.479 HD13 ' O ' ' A' ' 127' ' ' THR . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.434 ' OD1' HD12 ' A' ' 128' ' ' ILE . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.72 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.668 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.728 ' N ' HD13 ' A' ' 148' ' ' ILE . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.702 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.865 HD22 HD13 ' A' ' 97' ' ' LEU . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.808 ' SD ' HD11 ' A' ' 97' ' ' LEU . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.41 ' N ' ' HG3' ' A' ' 157' ' ' MET . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' B' ' 135' ' ' ARG . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.883 ' CD1' HG22 ' A' ' 124' ' ' THR . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.342 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.828 ' HB2' ' HB1' ' A' ' 123' ' ' ALA . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.549 HD13 ' CD1' ' B' ' 132' ' ' PHE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.668 ' HG3' HG13 ' A' ' 160' ' ' VAL . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.78 0.324 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.913 HD13 ' HA ' ' A' ' 154' ' ' LEU . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.797 HD12 HD23 ' A' ' 97' ' ' LEU . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.805 ' HA ' HD13 ' A' ' 119' ' ' ILE . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.677 HG23 ' CB ' ' A' ' 116' ' ' GLU . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.417 HD21 ' CG ' ' A' ' 134' ' ' GLU . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.677 ' CB ' HG23 ' A' ' 112' ' ' ILE . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.437 ' HA ' HD12 ' A' ' 133' ' ' ILE . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 104' ' ' PHE . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.892 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 132' ' ' ASP . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.664 ' HB3' ' CD1' ' B' ' 134' ' ' LEU . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.724 HG23 HD13 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.649 HG22 HG22 ' A' ' 129' ' ' THR . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 128' ' ' ILE . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.61 ' HB3' HD21 ' A' ' 121' ' ' LEU . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 117' ' ' LEU . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.417 ' CG ' HD21 ' A' ' 114' ' ' LEU . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.548 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.447 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.811 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.811 ' N ' HD13 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.407 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.696 ' N ' HD11 ' A' ' 148' ' ' ILE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.913 ' HA ' HD13 ' A' ' 97' ' ' LEU . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.472 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.548 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.788 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.94 HG22 ' HG3' ' B' ' 135' ' ' ARG . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.688 ' CD1' HD22 ' B' ' 134' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.724 HD13 HG23 ' A' ' 124' ' ' THR . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.94 ' HG3' HG22 ' A' ' 160' ' ' VAL . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . 0.425 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.85 0.357 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.851 HD11 ' CG ' ' A' ' 157' ' ' MET . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.431 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.659 HD12 HD23 ' A' ' 97' ' ' LEU . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.407 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 116' ' ' GLU . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 117' ' ' LEU . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.75 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 133' ' ' ILE . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.7 ' HB3' HD21 ' B' ' 134' ' ' LEU . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.577 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.493 HG21 HG22 ' A' ' 127' ' ' THR . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.436 ' N ' HG23 ' A' ' 124' ' ' THR . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 124' ' ' THR . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.619 HG21 ' CG ' ' A' ' 132' ' ' ASP . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.52 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.468 ' HB2' HG23 ' A' ' 129' ' ' THR . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.619 ' CG ' HG21 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.654 ' O ' HD13 ' A' ' 117' ' ' LEU . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.53 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.623 ' HB2' HD11 ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.431 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.87 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.87 ' N ' HD13 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.433 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.785 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.772 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.414 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.53 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.851 ' CG ' HD11 ' A' ' 97' ' ' LEU . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.862 HG13 ' HG2' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.732 ' O ' HD12 ' B' ' 134' ' ' LEU . 34.8 p90 . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.732 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG2' HG13 ' A' ' 160' ' ' VAL . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.436 ' O ' HD12 ' A' ' 97' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.778 0.323 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HG2' ' A' ' 157' ' ' MET . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.9 HD13 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.447 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.676 ' CD2' HD13 ' A' ' 112' ' ' ILE . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.816 HG23 ' HB3' ' A' ' 116' ' ' GLU . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.404 ' O ' HD23 ' A' ' 117' ' ' LEU . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 137' ' ' MET . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.816 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.777 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.495 HD12 ' CA ' ' A' ' 116' ' ' GLU . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.554 ' SD ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.928 HD12 HD11 ' A' ' 133' ' ' ILE . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.452 HG21 HG22 ' A' ' 127' ' ' THR . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.909 HG23 HG12 ' A' ' 128' ' ' ILE . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.909 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.847 ' HA ' HD11 ' A' ' 121' ' ' LEU . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.844 ' HB2' HD12 ' A' ' 128' ' ' ILE . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.928 HD11 HD12 ' A' ' 121' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.58 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 114' ' ' LEU . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.734 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.662 ' N ' HD13 ' A' ' 148' ' ' ILE . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.537 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.646 ' C ' HD11 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.734 ' N ' HD11 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.537 HD22 HD13 ' A' ' 97' ' ' LEU . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.58 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.935 HG22 ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.665 ' CE1' HD11 ' B' ' 134' ' ' LEU . 16.8 p90 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 119.901 -0.095 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.665 HD11 ' CE1' ' B' ' 132' ' ' PHE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.935 ' HA ' HG22 ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 100' ' ' LEU . 32.8 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.776 0.322 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.493 ' CG ' HD13 ' A' ' 154' ' ' LEU . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.932 HD23 HD12 ' A' ' 100' ' ' LEU . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.932 HD12 HD23 ' A' ' 97' ' ' LEU . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.649 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.457 ' O ' HD13 ' A' ' 117' ' ' LEU . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.649 ' CB ' HG23 ' A' ' 112' ' ' ILE . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.812 ' HB3' HG23 ' A' ' 133' ' ' ILE . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.674 HD11 ' CG1' ' A' ' 128' ' ' ILE . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.489 HG21 ' CE2' ' B' ' 132' ' ' PHE . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.678 ' CG ' HD12 ' A' ' 128' ' ' ILE . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.678 HD12 ' CG ' ' A' ' 126' ' ' GLU . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.812 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.457 ' HG3' HD23 ' A' ' 114' ' ' LEU . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.523 HD21 ' CD2' ' B' ' 134' ' ' LEU . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.414 ' CA ' HD21 ' A' ' 117' ' ' LEU . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.836 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.736 ' CE1' HD21 ' A' ' 154' ' ' LEU . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.651 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.736 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.458 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.663 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.824 ' HG3' HD21 ' A' ' 97' ' ' LEU . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 157' ' ' MET . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.2 OUTLIER . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.431 0.157 . . . . 0.0 110.919 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . 0.422 ' C ' HD12 ' B' ' 134' ' ' LEU . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.663 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.65 ' HG3' HG13 ' A' ' 160' ' ' VAL . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' A' ' 100' ' ' LEU . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.408 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.796 ' HD3' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 116' ' ' GLU . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 134' ' ' GLU . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.844 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.686 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.796 HD11 ' HD3' ' A' ' 106' ' ' LYS . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.686 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.529 HD22 HD11 ' A' ' 133' ' ' ILE . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 121' ' ' LEU . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.771 HD12 ' HB3' ' A' ' 132' ' ' ASP . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.771 ' HB3' HD12 ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.765 HG12 HD11 ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' A' ' 114' ' ' LEU . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.444 ' HG3' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.439 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.407 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.87 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.778 ' N ' HD13 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.668 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.514 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.87 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.727 HD22 HD13 ' A' ' 97' ' ' LEU . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.599 ' HG2' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.527 HG22 ' HA ' ' B' ' 135' ' ' ARG . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.421 ' N ' HD12 ' B' ' 134' ' ' LEU . 43.9 p90 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.781 0.324 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.421 HD12 ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.527 ' HA ' HG22 ' A' ' 160' ' ' VAL . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 160' ' ' VAL . 1.9 m-85 . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.773 0.32 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.45 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.77 ' CD ' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.693 HG23 ' HB2' ' A' ' 116' ' ' GLU . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.517 HD21 ' HG3' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.693 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.696 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.534 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.77 HD11 ' CD ' ' A' ' 106' ' ' LYS . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.935 HD13 HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.935 HG23 HD13 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.623 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.63 ' O ' HG22 ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.753 ' O ' HG23 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.696 HG23 ' HB3' ' A' ' 117' ' ' LEU . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' HD21 ' A' ' 114' ' ' LEU . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.445 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.453 ' HA ' HD11 ' A' ' 117' ' ' LEU . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.81 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.74 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.923 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.596 ' C ' HD11 ' A' ' 148' ' ' ILE . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.923 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.445 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.659 ' HG3' HD21 ' A' ' 97' ' ' LEU . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 111.408 0.151 . . . . 0.0 111.408 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.615 HD13 ' CE2' ' B' ' 138' ' ' PHE . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.791 HG23 ' HB3' ' A' ' 116' ' ' GLU . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.791 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.81 HD12 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.5 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.551 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.75 HD21 HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.766 ' O ' HD11 ' A' ' 128' ' ' ILE . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.657 ' O ' HD13 ' A' ' 128' ' ' ILE . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.432 ' O ' HG23 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.766 HD11 ' O ' ' A' ' 124' ' ' THR . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.713 HG22 ' HG ' ' A' ' 121' ' ' LEU . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.81 HG23 HD12 ' A' ' 117' ' ' LEU . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.54 HD21 ' HZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . 0.433 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.848 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.644 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.691 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.55 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.848 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 97' ' ' LEU . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.592 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.773 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.6 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.5 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 120.039 -0.029 . . . . 0.0 110.961 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.615 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.839 0.352 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.786 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 116' ' ' GLU . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.588 ' H ' HD22 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' HD21 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 128' ' ' ILE . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.488 HG23 ' N ' ' A' ' 125' ' ' GLY . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . 0.488 ' N ' HG23 ' A' ' 124' ' ' THR . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.487 HG22 ' N ' ' A' ' 128' ' ' ILE . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.521 HD13 ' CB ' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 133' ' ' ILE . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.521 ' CB ' HD13 ' A' ' 128' ' ' ILE . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.584 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . 0.486 ' HG3' HD13 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.735 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.64 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.518 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.719 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.659 ' CB ' HD13 ' A' ' 97' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.584 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.665 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.623 HG22 ' HG3' ' B' ' 135' ' ' ARG . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 34.4 p90 . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 120.735 0.302 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.408 HD21 ' HB3' ' A' ' 120' ' ' MET . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.623 ' HG3' HG22 ' A' ' 160' ' ' VAL . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.535 ' HE2' HD13 ' A' ' 100' ' ' LEU . 8.7 m-85 . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.839 0.352 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.825 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.495 HD13 ' HE1' ' B' ' 138' ' ' PHE . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 116' ' ' GLU . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.752 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.528 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.803 HD13 ' OG1' ' A' ' 124' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.803 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.477 ' O ' HG23 ' A' ' 129' ' ' THR . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.729 HG13 HD11 ' A' ' 121' ' ' LEU . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . 0.504 HG22 ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 117' ' ' LEU . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.604 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . 0.787 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 150' ' ' TYR . . . . . 0.964 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . 0.432 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . 0.825 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.964 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 156' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 160' ' ' VAL . . . . . 0.767 HG22 ' HG3' ' B' ' 135' ' ' ARG . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 132' ' ' PHE . . . . . 0.63 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.282 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 134' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HG3' HG22 ' A' ' 160' ' ' VAL . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 138' ' ' PHE . . . . . 0.495 ' HE1' HD13 ' A' ' 100' ' ' LEU . 3.1 m-85 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.809 0.338 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -83.28 161.3 21.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.871 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -142.86 163.26 27.35 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.501 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -84.85 106.57 16.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.852 0.358 . . . . 0.0 110.883 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -158.42 -45.8 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -73.56 -38.27 65.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.17 -32.68 70.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.882 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -60.79 -58.1 9.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.918 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.696 HD13 HD22 ' A' ' 154' ' ' LEU . 1.3 mt -70.07 -32.13 70.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.961 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.1 t -49.82 -37.55 30.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.009 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -84.55 -29.44 25.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.828 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.494 HD12 ' HA ' ' A' ' 97' ' ' LEU . 16.4 mt -68.82 -50.94 45.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -55.24 -41.91 72.77 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.127 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -57.93 -42.36 84.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.923 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 18.5 ttp -82.38 -27.32 32.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.475 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -72.59 -36.93 68.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.869 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -76.3 63.04 1.87 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.946 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -57.02 -27.66 61.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.122 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -69.83 -23.95 63.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.988 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.22 72.73 0.38 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -147.15 -46.71 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.824 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.56 -3.04 5.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.05 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.8 m-85 -134.1 162.66 31.5 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.919 0.359 . . . . 0.0 110.996 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.691 HG23 ' CB ' ' A' ' 116' ' ' GLU . 12.4 mt -119.5 140.03 44.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.895 0.378 . . . . 0.0 111.262 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.83 -170.53 2.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.761 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.847 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.5 OUTLIER -54.77 -28.32 47.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.101 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.25 -49.92 51.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.938 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.691 ' CB ' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -77.07 -35.74 56.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.999 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.589 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.04 -27.14 7.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.943 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt -63.97 -26.91 68.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.793 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.594 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.5 mt -50.25 -33.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.714 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.515 ' HG3' HD12 ' A' ' 121' ' ' LEU . 3.2 ptp -81.62 -34.02 31.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.762 0.315 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.807 HD22 HG12 ' A' ' 133' ' ' ILE . 7.5 mp -78.12 -28.98 48.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.06 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -26.48 62.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.997 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.04 -30.3 66.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.792 HG21 HD11 ' A' ' 128' ' ' ILE . 4.8 t -98.59 -43.56 6.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.027 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 60.71 30.7 73.12 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.441 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -84.39 -170.96 3.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.975 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 2.7 t -66.46 -26.41 67.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.038 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.792 HD11 HG21 ' A' ' 124' ' ' THR . 15.9 pt -50.67 -26.82 4.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.426 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.611 ' HA ' HD23 ' A' ' 121' ' ' LEU . 69.7 p -61.28 149.46 37.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 59.13 40.01 22.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.999 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -177.1 -60.1 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.595 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.24 -22.84 66.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.786 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.807 HG12 HD22 ' A' ' 121' ' ' LEU . 2.3 mt -63.84 -37.71 80.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.312 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.847 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -73.05 -31.25 64.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.048 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -86.03 -36.87 19.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.071 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.61 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.7 tp -67.05 -49.84 63.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.019 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -45.34 -30.0 1.19 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.247 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -54.97 -30.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.831 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.22 -53.12 33.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.78 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -59.2 -67.73 2.03 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.376 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -75.75 74.13 2.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 0.0 110.855 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 30.26 3.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -112.09 -11.34 13.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.335 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.76 44.52 1.6 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.901 0.382 . . . . 0.0 110.796 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -115.46 -33.69 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.5 20.63 5.39 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.707 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 3.1 ptt-85 -178.47 155.82 0.89 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.766 0.317 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.861 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -116.01 131.78 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.705 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.861 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.82 172.88 6.86 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.091 0.472 . . . . 0.0 111.715 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.475 ' CE1' HD21 ' A' ' 154' ' ' LEU . 6.2 t80 -53.38 88.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.252 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 t0 177.32 -66.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.193 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.625 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.6 mt-10 -70.22 -22.22 62.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.036 0.446 . . . . 0.0 110.067 178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.609 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 1.2 t80 -62.69 -27.75 69.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.198 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.696 HD22 HD13 ' A' ' 97' ' ' LEU . 6.7 mt -68.33 -25.86 65.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.761 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.61 -25.57 64.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.279 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.61 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -57.76 -62.21 1.96 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.556 179.545 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.586 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.1 ppp? -62.93 -27.08 69.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.047 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -38.18 26.69 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.872 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.35 -27.08 64.99 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.164 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.742 HG22 ' HA ' ' B' ' 135' ' ' ARG . 45.2 t -56.46 -29.81 29.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.767 0.318 . . . . 0.0 111.095 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.885 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 23.7 p . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.825 0.345 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.431 ' O ' ' CB ' ' B' ' 130' ' ' LYS . 4.3 mt-30 -136.49 -75.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' B' ' 129' ' ' GLN . 1.3 mtmm 84.04 -30.8 0.08 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.913 HD12 ' HB2' ' B' ' 135' ' ' ARG . 15.0 mm -86.74 133.93 28.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.857 0.36 . . . . 0.0 111.092 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.475 ' O ' HD12 ' B' ' 134' ' ' LEU . 23.4 p90 -175.66 98.35 0.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.956 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.6 -53.65 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 110.312 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' ' 134' ' ' LEU . 7.4 mp -43.54 -37.92 2.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.913 179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.913 ' HB2' HD12 ' B' ' 131' ' ' ILE . 42.2 ttt-85 -77.91 -53.56 7.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.03 152.01 51.96 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.522 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mmtp 63.08 30.38 16.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.948 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.491 ' HE1' HD13 ' A' ' 100' ' ' LEU . 6.3 m-85 -134.72 29.86 3.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.878 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -103.41 -50.27 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.768 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.13 146.4 5.38 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -83.05 113.2 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.435 2.09 . . . . 0.0 112.419 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 2.8 t -115.89 138.87 50.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.3 111.25 8.86 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -95.92 114.81 26.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.955 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -76.68 138.36 39.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.8 -45.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.157 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.438 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 5.4 tpp180 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.144 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.895 0.378 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -125.08 -50.14 1.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -176.51 -151.82 9.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.516 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -131.47 88.59 2.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.928 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.23 172.9 14.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.791 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 70.7 -62.07 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.062 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -46.67 -29.46 1.88 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.283 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -59.43 -39.25 82.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.904 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.654 HD13 ' HB3' ' A' ' 154' ' ' LEU . 2.9 mt -77.24 -29.81 54.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.871 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.6 -37.08 57.48 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.993 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -84.59 -30.04 25.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.858 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.643 HD13 ' CE1' ' B' ' 138' ' ' PHE . 15.5 mt -68.45 -44.7 74.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.0 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -53.6 -45.94 70.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.23 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -61.58 -55.91 25.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.1 mtm -62.63 -17.8 61.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.509 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.3 t80 -94.19 -40.46 10.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.73 0.3 . . . . 0.0 111.232 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -58.53 -77.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? 65.12 9.24 5.37 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.706 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -105.35 -14.35 15.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.637 0.256 . . . . 0.0 111.268 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 67.16 31.65 6.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.848 0.356 . . . . 0.0 110.97 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -116.42 -46.6 2.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.74 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.75 15.12 17.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.934 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.471 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.5 m-85 -143.97 159.17 43.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.667 0.27 . . . . 0.0 110.738 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.776 HG23 ' HB3' ' A' ' 116' ' ' GLU . 10.6 mt -117.64 133.89 62.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.931 0.396 . . . . 0.0 111.274 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.45 -170.86 2.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.788 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.504 ' HG ' HG22 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -54.16 -26.98 30.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.011 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.92 -55.12 7.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.918 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.776 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.9 mt-10 -69.44 -41.57 76.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.69 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -51.83 -26.1 9.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.027 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -64.03 -28.03 69.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.71 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.1 mt -48.52 -50.92 11.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.848 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.539 ' HB2' HD21 ' B' ' 134' ' ' LEU . 3.1 ptp -59.45 -37.15 77.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.749 0.309 . . . . 0.0 111.161 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 132' ' ' ASP . 4.9 mp -71.04 -34.73 71.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.004 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -25.67 63.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.68 -34.83 70.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.236 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.582 HG23 HD11 ' A' ' 128' ' ' ILE . 1.8 t -89.9 -42.6 11.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.051 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 48.88 28.1 7.03 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.829 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.73 44.34 1.15 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.861 0.363 . . . . 0.0 111.231 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 33.3 m 54.83 71.82 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.287 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.881 HG12 HD23 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -135.54 -34.68 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.355 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.52 ' HA ' HD22 ' A' ' 121' ' ' LEU . 34.9 p -47.22 157.28 0.2 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.409 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 59.11 38.06 23.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.856 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.63 -39.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.679 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -87.47 -28.95 21.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.9 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.69 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.3 mp -73.61 -32.3 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.055 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.66 -42.37 98.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.117 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -86.09 -39.06 17.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.207 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 117' ' ' LEU . 4.3 tp -58.23 -50.92 71.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.255 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 7.9 tpt -45.83 -30.04 1.55 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -56.63 -26.7 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.923 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -80.19 -49.78 11.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.975 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.421 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.62 -64.5 4.27 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.562 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -79.81 93.71 5.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.906 0.384 . . . . 0.0 110.995 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 14.1 mtpp -105.33 28.36 7.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.896 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 17.8 m-20 -111.92 -11.36 13.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.28 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 44.7 t30 65.75 43.64 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -115.46 -39.38 3.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.795 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 138.33 -25.14 2.9 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.649 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.96 167.41 21.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.869 0.366 . . . . 0.0 111.064 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.757 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.93 130.27 70.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.582 179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.757 ' N ' HD13 ' A' ' 148' ' ' ILE . 38.7 t70 -115.74 161.57 18.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.885 0.374 . . . . 0.0 111.375 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.678 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -43.59 91.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.704 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.441 ' N ' ' O ' ' A' ' 149' ' ' ASP . 19.6 t0 174.67 -66.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.788 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -70.43 -25.42 63.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.762 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.458 ' N ' HD11 ' A' ' 148' ' ' ILE . 0.7 OUTLIER -61.1 -31.79 71.47 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.269 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.678 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.3 mt -64.31 -21.82 66.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.626 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -21.2 58.16 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.624 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.551 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.37 -60.53 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.561 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 97' ' ' LEU . 11.6 ptm -54.76 -31.6 58.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.265 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.77 -32.19 5.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.091 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.13 -33.63 86.43 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.036 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.914 HG22 ' HA ' ' B' ' 135' ' ' ARG . 48.0 t -61.5 -25.9 38.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.806 0.336 . . . . 0.0 111.096 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.913 179.936 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.826 0.346 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -139.05 31.29 2.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 30.8 mtmt 60.64 101.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.991 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.656 ' N ' HD12 ' B' ' 131' ' ' ILE . 0.0 OUTLIER -144.72 165.94 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.937 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -144.81 -98.12 0.1 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.594 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -82.19 3.29 27.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.756 0.313 . . . . 0.0 111.166 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 134' ' ' LEU . 2.7 mp -91.31 -50.68 5.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.914 ' HA ' HG22 ' A' ' 160' ' ' VAL . 52.1 ttt180 -53.59 -41.77 66.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.31 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.83 17.42 40.93 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.309 -0.948 . . . . 0.0 113.16 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.86 31.04 1.44 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.024 0.44 . . . . 0.0 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.835 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.9 OUTLIER -134.08 30.32 3.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.941 -179.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm -112.03 -61.44 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.12 137.25 12.7 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.967 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -88.91 134.8 2.7 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.582 2.188 . . . . 0.0 112.577 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.491 HG22 ' H ' ' B' ' 143' ' ' LEU . 0.2 OUTLIER 56.05 178.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 179.757 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.491 ' H ' HG22 ' B' ' 142' ' ' THR . 76.7 mt 61.63 -81.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 61.96 121.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.871 0.367 . . . . 0.0 110.934 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 63.2 165.64 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.881 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.3 p -43.85 -45.5 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.123 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.443 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.171 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.775 0.322 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt 61.24 112.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.843 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -140.6 -81.98 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.57 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -27.2 7.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.671 0.272 . . . . 0.0 111.155 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 t -94.96 -63.68 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 111.208 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -33.08 64.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.24 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -58.82 -27.62 65.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -65.57 -63.71 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.864 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.798 HD21 ' CG ' ' A' ' 157' ' ' MET . 21.3 mt -59.8 -29.91 68.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.032 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 7.8 t -49.79 -53.59 24.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.888 0.375 . . . . 0.0 110.682 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -83.28 -28.73 28.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.391 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.568 HD23 HD23 ' A' ' 97' ' ' LEU . 12.2 tp -57.83 -30.09 65.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.881 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.443 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 4.0 t80 -68.83 -55.36 11.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.156 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -25.11 13.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.295 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.1 ttp -63.3 -26.75 68.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.269 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.799 ' HA ' HD13 ' A' ' 119' ' ' ILE . 3.6 m-85 -103.15 -42.56 5.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -55.11 -83.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.247 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.22 12.35 4.09 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.725 0.298 . . . . 0.0 111.42 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 47.1 t30 -113.22 -14.77 12.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.376 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 74.56 34.26 0.77 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.837 0.351 . . . . 0.0 111.128 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -116.42 -45.98 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.594 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 101.74 26.06 7.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.739 -0.744 . . . . 0.0 113.056 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.2 m-85 -143.46 156.13 44.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.759 0.279 . . . . 0.0 111.14 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.694 HG23 ' CB ' ' A' ' 116' ' ' GLU . 16.6 mt -121.66 132.94 69.62 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.059 0 CA-C-O 120.902 0.382 . . . . 0.0 111.271 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -118.79 -175.37 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -51.22 -35.55 37.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.241 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.16 -50.81 59.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.865 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.694 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.2 mt-10 -72.58 -24.56 61.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.93 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.906 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -61.88 -17.91 58.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.992 179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.6 ttpt -75.77 -22.18 56.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.807 0.337 . . . . 0.0 110.855 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.799 HD13 ' HA ' ' A' ' 104' ' ' PHE . 6.1 mt -54.5 -44.95 70.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.547 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.602 ' HB2' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -63.69 -36.58 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.894 0.378 . . . . 0.0 110.326 179.438 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.746 HD11 ' HB3' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -77.12 -25.72 52.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.737 179.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -30.41 63.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.597 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.48 -25.68 62.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.029 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.46 -49.52 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.745 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.65 37.25 92.03 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.493 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -108.34 -177.68 3.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.827 0.346 . . . . 0.0 110.914 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.0 t -59.33 -21.37 59.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.144 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.459 HG13 HD23 ' A' ' 121' ' ' LEU . 13.9 pt -51.52 -26.28 6.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.473 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.553 ' HA ' HD22 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -56.84 153.84 10.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.933 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.13 30.88 19.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -167.03 -44.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.746 ' HB3' HD11 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -72.79 -30.62 64.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.906 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mp -67.14 -31.22 52.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.0 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.1 -37.52 58.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.171 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -86.03 -32.47 21.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.752 ' HG ' HD11 ' A' ' 117' ' ' LEU . 9.5 tp -68.93 -50.69 47.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.129 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.486 ' SD ' HD23 ' A' ' 117' ' ' LEU . 11.9 tpt -45.23 -30.6 1.25 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.322 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -27.01 55.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.024 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.77 -50.82 11.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.402 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.77 -66.87 2.49 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.381 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -82.63 81.11 8.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.887 0.375 . . . . 0.0 110.904 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.2 mttt -105.99 30.08 6.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.936 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -111.55 1.19 16.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.391 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 59.17 40.33 21.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.852 0.358 . . . . 0.0 110.853 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -115.42 -42.29 3.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.24 21.99 4.28 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.907 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.16 147.18 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.097 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.866 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 139.49 42.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.346 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.866 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.4 p30 -115.87 174.71 5.89 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.292 0.568 . . . . 0.0 112.39 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.849 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.5 t80 -47.7 -41.6 23.07 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.669 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -60.78 -63.87 1.15 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.557 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -60.22 -24.21 64.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.933 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.7 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.5 t80 -60.23 -42.73 95.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.901 0.381 . . . . 0.0 110.452 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.849 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.7 mt -57.58 -19.12 23.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.861 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.3 tt0 -68.56 -30.73 69.57 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.925 0.393 . . . . 0.0 110.432 179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.705 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -50.66 -64.42 0.82 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.926 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.798 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.0 mmt -71.16 -35.59 71.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.482 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.86 -29.16 1.28 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.336 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.28 -24.81 67.53 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.523 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.682 HG13 ' CG ' ' B' ' 135' ' ' ARG . 36.1 t -49.45 -29.08 3.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.776 0.322 . . . . 0.0 111.376 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.877 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.791 0.329 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -110.6 -30.43 7.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.051 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 39.5 mmtt -109.22 84.0 1.85 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.039 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.846 HD12 ' HB2' ' B' ' 135' ' ' ARG . 13.2 mm -87.66 147.12 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.739 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.963 ' O ' HD12 ' B' ' 134' ' ' LEU . 27.2 p90 -176.91 106.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.106 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 71.65 -55.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.393 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.963 HD12 ' O ' ' B' ' 132' ' ' PHE . 4.2 mp -42.34 -46.98 4.78 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.1 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.846 ' HB2' HD12 ' B' ' 131' ' ' ILE . 2.2 ttt180 -82.84 176.07 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.983 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 71.04 130.42 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.733 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.54 26.13 12.38 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 0.0 111.202 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 14.0 m-85 -131.24 27.28 4.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.86 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.25 -179.1 5.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.007 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.404 ' NE ' ' HD2' ' B' ' 141' ' ' PRO . 6.3 tpt180 -137.3 139.88 29.15 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.892 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.404 ' HD2' ' NE ' ' B' ' 140' ' ' ARG . 97.5 Cg_endo -88.82 104.47 0.42 Allowed 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.812 2.341 . . . . 0.0 112.53 -179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 8.6 m -92.84 -57.33 2.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.72 112.1 16.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.71 100.04 2.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 39.9 ptt85 -99.51 151.2 21.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.915 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.13 154.78 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.482 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.872 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 14.5 ptm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.871 0.367 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -155.97 148.81 24.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -97.57 70.36 0.72 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.541 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.9 mttt -73.05 155.45 39.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -159.67 -45.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.882 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.73 -32.38 62.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.905 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -68.9 -29.1 67.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.966 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.507 ' O ' HD13 ' A' ' 100' ' ' LEU . 4.7 tt0 -56.28 -64.84 0.73 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.636 ' HA ' HD22 ' A' ' 100' ' ' LEU . 1.1 mt -54.0 -27.87 34.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.056 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 t -47.98 -51.92 21.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.78 -25.12 61.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.877 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.636 HD22 ' HA ' ' A' ' 97' ' ' LEU . 5.4 mp -67.74 -48.41 66.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.007 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.469 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 18.7 t80 -55.69 -60.64 3.15 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.066 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -57.35 -31.48 65.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.972 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 40.1 ttp -78.15 -29.72 48.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.896 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.436 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.3 t80 -83.36 -45.52 13.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.52 66.86 0.33 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.979 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -26.14 68.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -69.45 -27.4 65.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.21 60.81 1.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -116.5 -37.87 3.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.29 -22.7 3.94 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.615 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CE2' ' HD2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -145.04 -178.55 6.1 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.768 0.318 . . . . 0.0 110.671 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.61 HG23 ' HB3' ' A' ' 116' ' ' GLU . 6.9 mt -115.85 130.5 70.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 111.115 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.42 -166.39 1.18 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.4 mp -54.19 -62.0 1.94 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.104 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -52.38 -47.89 65.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.754 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.1 tp10 -61.47 -35.51 77.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.627 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.763 HD23 HG23 ' A' ' 133' ' ' ILE . 1.2 tp -62.13 -24.42 67.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.888 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -67.56 -13.6 62.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.367 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.606 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.4 mt -68.15 -35.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.878 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.599 ' SD ' HD21 ' B' ' 134' ' ' LEU . 6.7 ptp -71.73 -39.11 70.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 1.061 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -78.67 -21.61 48.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.137 179.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -25.42 64.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.764 0.316 . . . . 0.0 110.891 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.62 -34.49 65.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.19 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.4 t -89.57 -38.87 13.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.9 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 65.33 27.56 72.58 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.592 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.62 -172.59 4.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.7 t -91.51 48.78 1.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.854 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.402 ' HB ' ' CB ' ' A' ' 132' ' ' ASP . 33.4 pt -114.64 10.15 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.442 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.71 HG22 HD12 ' A' ' 121' ' ' LEU . 28.5 p -80.49 152.47 28.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.861 0.362 . . . . 0.0 110.938 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 68.98 -63.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.243 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -67.08 -69.22 0.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.618 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.402 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 0.3 OUTLIER -56.62 -42.65 79.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.445 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 1.061 HD11 HD11 ' A' ' 121' ' ' LEU . 2.5 mt -50.67 -33.02 11.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.481 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -77.15 -28.62 54.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.0 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -85.99 -45.91 11.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.084 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.474 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.1 tp -59.06 -50.06 75.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.04 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 10.5 tpt -44.3 -30.19 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.374 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -54.77 -30.29 56.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.903 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -53.02 13.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.743 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.403 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -61.09 -50.23 69.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.388 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -113.02 110.83 21.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -126.02 31.64 5.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.063 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -123.21 13.04 9.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.283 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.5 t30 53.35 37.66 25.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.852 0.358 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -115.44 -35.34 4.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.037 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 82.64 44.63 7.21 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.503 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD2' ' CE2' ' A' ' 111' ' ' TYR . 93.5 mtm-85 -155.86 106.88 2.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.824 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.92 123.16 70.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.781 179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.643 ' N ' HD13 ' A' ' 148' ' ' ILE . 6.6 p-10 -153.59 128.74 9.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.985 0.421 . . . . 0.0 112.037 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.548 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 50.03 -85.87 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.426 179.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.6 t0 -32.6 -63.34 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.556 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.4 mt-10 -79.69 -27.02 40.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.932 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.824 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.2 t80 -61.03 -54.95 38.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.575 ' HA ' HD22 ' A' ' 97' ' ' LEU . 8.0 mt -49.55 -26.61 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.238 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.3 tt0 -72.27 -27.94 62.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.916 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.638 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.5 OUTLIER -57.6 -57.01 14.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.242 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.699 ' O ' HG23 ' A' ' 160' ' ' VAL . 5.5 mmt -79.37 -33.69 42.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.003 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.432 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.68 -29.82 3.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.926 179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.31 -27.34 73.74 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.335 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.857 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.6 t -51.19 -32.01 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.27 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . 0.507 HG23 ' O ' ' B' ' 128' ' ' THR . 6.7 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.852 0.358 . . . . 0.0 111.156 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -125.45 103.03 7.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.891 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt 68.12 -63.12 0.34 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.186 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.733 ' H ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -112.21 172.64 2.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 0.0 110.972 179.856 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.568 ' H ' HG22 ' B' ' 131' ' ' ILE . 0.2 OUTLIER -147.16 -107.78 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.071 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -75.64 -9.31 58.48 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.638 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.4 mp -70.55 -41.68 72.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.584 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.857 ' HG3' HG22 ' A' ' 160' ' ' VAL . 23.3 ttp85 -109.51 -176.98 3.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.74 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.478 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 61.37 17.06 51.97 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.572 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -155.39 -39.81 0.08 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.082 0.467 . . . . 0.0 109.895 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.573 ' CB ' HG21 ' A' ' 160' ' ' VAL . 5.3 m-85 -69.06 64.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.777 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.638 ' CG ' HG12 ' A' ' 160' ' ' VAL . 8.0 mttt -123.24 -76.79 0.59 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.963 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -147.53 139.85 14.27 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.92 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo -56.84 122.94 12.7 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.468 2.112 . . . . 0.0 112.224 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.2 p -131.75 -51.29 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 14.1 mt -145.61 125.3 13.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.884 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.67 -53.45 0.54 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.934 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -157.31 153.01 26.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.446 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.7 p -43.03 -45.24 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.348 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.446 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 14.6 mmm180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.848 0.356 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.06 97.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.61 50.0 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.538 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -140.69 -54.87 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.369 . . . . 0.0 110.902 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 m -91.17 -27.94 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -56.93 -23.57 46.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.172 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -54.86 -43.81 73.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 111.029 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -57.01 -61.98 2.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.835 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 154' ' ' LEU . 5.8 mt -60.89 -28.24 68.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.957 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 7.5 t -50.43 -51.61 45.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.99 0.424 . . . . 0.0 110.416 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.54 -26.83 27.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.358 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.635 HD21 ' CE1' ' B' ' 138' ' ' PHE . 7.8 tp -63.18 -25.44 68.34 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.996 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.407 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 28.0 t80 -82.62 -47.91 11.55 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.081 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -30.88 63.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.056 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -21.04 30.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.135 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.431 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -88.73 -42.5 11.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.113 -179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -58.43 -79.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.03 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 8.39 6.12 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.671 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 15.7 t30 -105.12 -14.33 15.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.625 0.25 . . . . 0.0 111.302 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.71 31.1 4.67 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 111.07 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.4 p-10 -116.52 -41.17 3.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 106.32 10.35 29.72 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.897 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.0 m-85 -140.36 162.69 34.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.73 0.265 . . . . 0.0 110.681 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.756 HG23 ' CB ' ' A' ' 116' ' ' GLU . 18.3 mt -116.27 135.49 56.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-O 120.926 0.393 . . . . 0.0 111.273 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.65 -173.86 2.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.699 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.7 mp -48.25 -28.65 3.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.256 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -72.53 -64.24 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.931 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.756 ' CB ' HG23 ' A' ' 112' ' ' ILE . 11.4 mp0 -62.18 -44.09 97.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.936 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.724 HD13 ' HE3' ' A' ' 137' ' ' MET . 3.1 tp -49.71 -28.54 6.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.009 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -62.33 -25.75 68.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.775 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.563 HD12 ' O ' ' A' ' 116' ' ' GLU . 5.5 mt -51.7 -48.73 37.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.467 ' HB2' HD21 ' B' ' 134' ' ' LEU . 4.1 ptp -59.06 -36.19 74.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.813 0.34 . . . . 0.0 110.831 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.808 HD11 HG13 ' A' ' 128' ' ' ILE . 0.8 OUTLIER -70.04 -30.66 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.802 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -53.16 -32.12 46.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.653 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.73 -27.3 65.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.92 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.655 HG21 ' CD2' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -93.59 -64.13 1.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.899 -179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.426 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.16 39.3 41.81 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.684 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.06 78.54 1.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.908 0.385 . . . . 0.0 111.013 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.766 ' O ' HG23 ' A' ' 128' ' ' ILE . 61.1 m 48.17 86.41 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.405 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.808 HG13 HD11 ' A' ' 121' ' ' LEU . 1.1 pt -171.71 -33.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.017 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.76 HG23 HD12 ' A' ' 121' ' ' LEU . 3.2 p -49.13 157.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 57.03 24.92 10.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.888 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.11 -48.64 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.706 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.72 -31.8 67.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.76 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.681 HG23 HD23 ' A' ' 117' ' ' LEU . 2.9 mp -69.46 -30.38 45.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -72.85 -37.15 67.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.986 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.97 -44.57 12.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.026 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.482 ' O ' HD12 ' A' ' 136' ' ' LEU . 2.5 tp -59.07 -42.76 91.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.028 0.442 . . . . 0.0 110.884 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.724 ' HE3' HD13 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -44.3 -31.31 0.99 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.253 179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -31.13 68.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.818 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.99 -53.05 19.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.401 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.45 -66.72 2.6 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.365 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -88.32 98.71 11.75 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.385 . . . . 0.0 110.931 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -103.35 31.11 4.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 58.4 m-20 -114.4 -7.23 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.285 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 66.05 41.23 3.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.901 0.381 . . . . 0.0 110.958 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -31.64 5.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.017 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 101.56 29.28 6.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.571 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -163.01 134.8 5.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.916 0.389 . . . . 0.0 111.028 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.828 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.89 133.36 62.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.828 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.9 p30 -115.8 174.46 6.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.384 0.611 . . . . 0.0 112.341 -178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.822 ' CE1' HD21 ' A' ' 154' ' ' LEU . 5.7 t80 -42.53 -40.69 2.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.799 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -60.97 -64.87 0.81 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.553 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.0 OUTLIER -60.21 -23.99 64.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.913 179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.751 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -60.17 -43.49 95.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.92 0.39 . . . . 0.0 110.494 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.822 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -59.68 -21.72 60.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.783 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.38 -24.2 61.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.94 0.4 . . . . 0.0 110.317 179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -56.7 17.22 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.355 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.718 ' SD ' HD11 ' A' ' 97' ' ' LEU . 0.1 OUTLIER -68.78 -26.13 65.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.402 -179.881 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 157' ' ' MET . 4.1 mttm -47.3 -37.22 10.46 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.156 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.45 -30.08 76.73 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.02 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.863 HG22 ' HG3' ' B' ' 135' ' ' ARG . 25.9 t -63.12 -25.86 39.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 111.039 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.3 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.802 0.334 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -163.71 40.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.965 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.415 ' O ' ' CE1' ' B' ' 132' ' ' PHE . 0.2 OUTLIER 70.01 -63.39 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.078 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.503 HG23 ' HB2' ' B' ' 135' ' ' ARG . 12.8 mm -78.4 152.2 5.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.173 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.87 ' O ' HD12 ' B' ' 134' ' ' LEU . 32.6 p90 178.34 109.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.217 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 71.57 -55.43 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.59 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.87 HD12 ' O ' ' B' ' 132' ' ' PHE . 2.4 mp -42.7 -51.29 5.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.597 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.863 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -60.59 -177.56 0.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.024 0.44 . . . . 0.0 110.78 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.55 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 57.02 20.71 35.32 Favored Glycine 0 N--CA 1.444 -0.767 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.387 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -153.82 -37.59 0.1 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.188 0.518 . . . . 0.0 109.61 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.635 ' CE1' HD21 ' A' ' 100' ' ' LEU . 2.4 m-85 -72.98 58.81 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.461 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.597 ' HG2' HG12 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -168.5 -169.92 1.15 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.669 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.94 154.13 64.22 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.914 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -84.58 -175.47 2.14 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.586 2.191 . . . . 0.0 112.512 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.5 123.76 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 39.1 mt 60.15 159.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.17 155.23 41.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 62.79 39.0 11.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -70.96 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.286 -179.732 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.814 0.34 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 mtmm 60.29 179.19 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -160.73 95.24 0.14 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.547 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.57 -174.89 5.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.28 -59.98 1.67 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.867 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -73.85 -30.06 62.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.89 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -62.44 -17.88 60.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -76.76 -51.28 11.7 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.739 0.304 . . . . 0.0 110.975 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.691 HD21 ' HG2' ' A' ' 157' ' ' MET . 7.0 mt -60.37 -35.15 75.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.887 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 94.2 p -48.25 -72.4 0.05 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.06 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -58.73 -22.3 57.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.734 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 97' ' ' LEU . 0.6 OUTLIER -64.77 -55.59 18.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.165 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.448 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 36.7 t80 -56.62 -30.65 63.5 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.03 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -27.63 69.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.031 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 45.9 mtm -92.08 -38.96 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.119 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -71.21 -43.94 66.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.994 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.414 ' HB2' ' CE1' ' A' ' 101' ' ' PHE . 11.3 t0 -73.48 63.84 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -20.96 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.141 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -68.4 -27.7 66.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.824 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.87 62.27 0.91 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -128.91 -43.6 1.35 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.9 -32.97 2.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.393 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.33 -175.76 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.673 0.273 . . . . 0.0 110.52 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 116' ' ' GLU . 15.9 mt -116.26 139.47 42.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.852 0.358 . . . . 0.0 111.11 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.52 -175.6 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.97 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.1 mp -58.37 -45.56 88.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.08 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -56.91 -27.16 60.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.18 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.625 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.6 mt-10 -89.18 -35.32 16.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.988 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 114' ' ' LEU . 68.9 mt -48.86 -27.57 3.14 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.986 0.422 . . . . 0.0 110.972 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt -64.75 -31.07 72.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.147 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.597 HD12 ' O ' ' A' ' 116' ' ' GLU . 8.3 mt -46.51 -59.12 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.639 -179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.468 ' HG3' HD21 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -59.67 -29.81 68.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.893 HD11 HG13 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -68.95 -30.2 68.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.808 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -51.29 -30.52 18.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.024 0.44 . . . . 0.0 110.646 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.08 -25.78 61.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.265 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.742 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.3 OUTLIER -90.06 -52.27 5.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.819 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 56.3 42.11 88.2 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.639 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -118.31 -177.86 3.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.806 0.336 . . . . 0.0 110.899 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 9.0 t -57.57 -23.56 51.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.08 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.893 HG13 HD11 ' A' ' 121' ' ' LEU . 20.4 pt -53.87 -23.91 9.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.434 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.63 HG22 HD12 ' A' ' 121' ' ' LEU . 23.6 p -48.79 157.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.848 0.356 . . . . 0.0 111.199 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 68.77 -67.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.149 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.78 -56.86 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.859 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -58.42 -23.2 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.016 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.633 ' O ' HD13 ' A' ' 117' ' ' LEU . 17.0 mm -60.75 -45.88 97.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -79.94 -26.41 40.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.133 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -79.64 -35.23 39.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.26 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.64 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.7 tp -65.66 -45.31 83.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.931 0.396 . . . . 0.0 110.851 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.775 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -43.22 -31.62 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.442 -179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -54.83 -28.41 49.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.906 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -89.42 -44.83 9.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.893 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.0 -59.75 10.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.257 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -84.54 -71.79 0.5 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.817 0.341 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt 58.42 30.31 19.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.004 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -122.24 1.6 9.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.369 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 61.1 t30 59.08 26.31 14.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.775 0.321 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -123.23 -39.68 2.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.84 70.11 1.08 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.524 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -176.98 106.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 111.058 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.69 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 109.61 28.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.6 p-10 -139.98 120.07 13.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.294 -0.412 . . . . 0.0 112.062 -179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.612 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 49.95 -83.4 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.625 178.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.443 ' N ' ' O ' ' A' ' 149' ' ' ASP . 16.3 m-20 -37.16 -52.21 1.02 Allowed 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.469 ' CB ' HG12 ' A' ' 148' ' ' ILE . 6.9 mt-10 -83.56 -27.71 29.1 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.241 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.69 ' CA ' HD11 ' A' ' 148' ' ' ILE . 3.6 t80 -61.72 -49.05 77.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.898 0.38 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.652 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.2 mt -54.67 -20.75 8.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.227 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -80.35 -15.75 56.16 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.852 0.358 . . . . 0.0 110.632 178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.67 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -67.6 -55.79 11.96 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.583 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.691 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.2 ppp? -63.78 -26.07 68.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -36.95 11.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -62.1 -30.79 76.68 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.905 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.841 HG22 ' HA ' ' B' ' 135' ' ' ARG . 60.5 t -57.47 -29.08 32.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.816 0.341 . . . . 0.0 111.015 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.804 0.335 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.39 126.02 53.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.883 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 4.6 tppt? -138.41 142.86 39.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.966 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.7 mm -65.75 154.75 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.827 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.532 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -112.39 -112.77 0.33 Allowed 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.739 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -70.69 -9.02 56.2 Favored 'General case' 0 C--O 1.231 0.117 0 O-C-N 122.183 -0.323 . . . . 0.0 111.501 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.715 ' HB2' HG23 ' B' ' 131' ' ' ILE . 6.1 mp -66.32 -39.28 89.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.128 0.49 . . . . 0.0 110.516 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.841 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.5 ttt180 -64.6 -46.39 82.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.902 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.28 158.14 46.14 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.457 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? 60.21 28.8 18.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.89 0.376 . . . . 0.0 110.843 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.478 ' HE1' HD23 ' A' ' 100' ' ' LEU . 6.2 m-85 -137.38 30.34 2.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.829 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.535 ' HG2' HG11 ' A' ' 160' ' ' VAL . 10.6 mttt -127.54 -58.65 1.25 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.923 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.37 156.98 35.15 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.028 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.44 117.71 3.46 Favored 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.423 2.082 . . . . 0.0 112.351 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 6.0 t -95.76 133.27 40.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.925 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.2 mp -141.13 158.48 43.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.937 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.93 30.95 4.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 59.78 98.19 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.866 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.8 -29.96 3.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.51 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 23.8 mtt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.841 -179.981 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.807 0.337 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.63 166.7 22.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 113.26 27.13 3.76 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.546 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -132.88 126.92 33.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.809 0.338 . . . . 0.0 110.856 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.2 t 62.09 151.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.721 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 71.92 -60.83 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -47.08 -32.65 4.27 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.135 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.545 ' O ' HD13 ' A' ' 100' ' ' LEU . 2.9 mt-10 -58.7 -61.98 2.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.63 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.804 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.4 OUTLIER -62.55 -24.66 67.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.821 179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -50.95 -47.19 61.25 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.55 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -73.48 -31.18 63.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.25 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 96' ' ' GLU . 9.1 mp -59.77 -46.98 87.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.562 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.422 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 15.7 t80 -60.24 -43.96 95.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.042 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -58.35 -35.54 72.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.989 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.3 mtt -85.19 -31.08 23.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -76.91 -30.39 56.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.906 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -84.58 63.54 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -25.78 66.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.005 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -69.76 -24.11 63.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.942 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.53 74.08 0.41 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.127 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -144.09 -46.85 0.27 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 128.82 -10.11 6.35 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.793 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -131.44 162.18 30.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.673 0.236 . . . . 0.0 110.721 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.831 HG23 ' HB3' ' A' ' 116' ' ' GLU . 11.5 mt -116.35 128.84 73.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-O 120.908 0.385 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -121.47 -168.38 1.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.887 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.661 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -56.12 -29.62 60.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.152 -179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.22 -47.43 67.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.128 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.831 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.2 mt-10 -77.53 -29.72 52.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.843 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -55.53 -29.54 59.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.874 0.369 . . . . 0.0 110.846 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -61.68 -24.9 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.69 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.527 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.9 mt -60.91 -26.15 37.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.098 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.674 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.3 OUTLIER -73.62 -42.6 61.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.607 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 1.063 HD11 HD11 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -83.52 -29.89 27.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.717 179.767 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.33 -27.71 16.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.101 0.477 . . . . 0.0 110.229 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.49 -27.46 63.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.792 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.611 HG23 ' HB3' ' B' ' 133' ' ' ASP . 0.6 OUTLIER -94.57 -64.75 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.904 -179.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.8 37.19 6.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.493 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.482 ' C ' HD13 ' A' ' 128' ' ' ILE . 0.0 OUTLIER -88.57 -160.96 0.7 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.691 0.281 . . . . 0.0 110.874 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.917 ' O ' HG23 ' A' ' 129' ' ' THR . 7.5 t -91.64 13.88 16.74 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.312 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.803 ' H ' HD13 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -48.69 -38.47 9.84 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.618 -179.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.917 HG23 ' O ' ' A' ' 127' ' ' THR . 14.9 p 53.27 175.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.689 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 133' ' ' ILE . 1.8 tp10 -56.35 -33.57 65.78 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -44.74 63.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.87 0.367 . . . . 0.0 110.908 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.513 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 34.7 t70 -62.65 -30.48 71.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.069 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 1.063 HD11 HD11 ' A' ' 121' ' ' LEU . 26.4 mm -57.32 -51.96 62.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.195 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.484 ' HG3' HD11 ' A' ' 114' ' ' LEU . 3.7 tt0 -61.75 -27.6 68.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -75.75 -57.84 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.204 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HD11 ' A' ' 117' ' ' LEU . 8.1 tp -58.06 -49.55 76.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.044 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.492 ' SD ' HD23 ' A' ' 117' ' ' LEU . 13.1 tpt -46.15 -29.7 1.65 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.186 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -55.23 -28.13 51.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.869 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -47.97 19.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.87 -62.41 6.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.509 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -89.23 76.9 7.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.858 0.361 . . . . 0.0 110.808 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -98.07 29.57 3.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.934 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -112.01 -14.72 13.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.206 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 66.44 50.28 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.937 0.398 . . . . 0.0 110.812 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -115.39 -39.36 3.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 151.64 -31.14 0.93 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.648 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 2.7 mtm180 -158.05 -176.89 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.901 0.382 . . . . 0.0 111.044 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.694 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.99 132.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.69 179.87 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.694 ' N ' HD13 ' A' ' 148' ' ' ILE . 4.3 p30 -115.78 176.13 5.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.992 0.425 . . . . 0.0 111.589 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.477 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.5 t80 -57.03 85.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.174 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 26.4 t70 179.67 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.182 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' A' ' 148' ' ' ILE . 4.0 mt-10 -70.09 -24.98 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.804 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -63.45 -26.34 68.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.565 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.697 ' HA ' HD22 ' A' ' 97' ' ' LEU . 6.9 mt -62.58 -36.06 81.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.437 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 2.8 tt0 -63.87 -27.97 69.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.583 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.658 ' CE1' HD11 ' B' ' 131' ' ' ILE . 0.3 OUTLIER -55.33 -56.01 24.97 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.003 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.713 ' CG ' HD21 ' A' ' 97' ' ' LEU . 5.2 mmt -85.36 -36.31 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.051 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.42 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.3 OUTLIER -48.2 -34.29 9.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.15 -29.69 71.8 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.193 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.84 HG22 ' HG3' ' B' ' 135' ' ' ARG . 40.3 t -51.28 -32.21 12.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.834 0.35 . . . . 0.0 111.255 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.926 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.756 0.312 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.2 117.4 8.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.894 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -129.54 -50.14 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.853 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.658 HD11 ' CE1' ' A' ' 156' ' ' PHE . 4.8 mm -59.25 154.86 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.999 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.492 ' HD2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -133.29 -110.16 0.23 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.074 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' A' ' 124' ' ' THR . 1.1 t70 -71.8 61.94 0.41 Allowed 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.149 0.499 . . . . 0.0 110.153 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.573 HD12 ' C ' ' B' ' 133' ' ' ASP . 3.8 mp -149.56 -51.2 0.15 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.365 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.84 ' HG3' HG22 ' A' ' 160' ' ' VAL . 5.8 ttp-105 -62.06 -178.12 0.15 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.761 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.634 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 58.11 43.78 95.07 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.388 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 ptmm? 176.59 -33.49 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.02 0.438 . . . . 0.0 109.865 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.604 ' CB ' HG21 ' A' ' 160' ' ' VAL . 1.5 m-85 -73.15 57.4 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.53 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -118.49 -31.85 4.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.922 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.41 ' HB2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -149.23 157.44 39.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.794 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' B' ' 140' ' ' ARG . 73.5 Cg_endo -76.68 89.89 1.26 Allowed 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.359 2.04 . . . . 0.0 112.394 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 4.0 p -149.62 100.33 2.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.864 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 33.5 mt -111.66 -33.77 6.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.953 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -95.01 44.52 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -141.25 120.35 12.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.901 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.63 157.88 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.538 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 1.3 mtm-85 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.885 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 30.8 mtt . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.818 0.342 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -117.92 -173.86 2.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -159.79 135.55 4.17 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.557 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -136.21 -65.47 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.869 0.366 . . . . 0.0 110.922 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -64.91 -31.05 72.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.29 -30.0 63.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.91 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -58.78 -33.37 70.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -65.5 -50.35 65.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.914 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.844 HD21 ' HG3' ' A' ' 157' ' ' MET . 1.7 mt -74.65 -40.9 61.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.065 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.7 p -47.91 -34.86 9.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.007 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.61 -35.39 22.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.922 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.574 HD12 ' SD ' ' A' ' 157' ' ' MET . 15.9 mt -70.24 -34.87 73.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.052 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 6.0 t80 -56.38 -56.96 14.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.94 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.1 ttt85 -59.47 -28.8 67.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.96 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -83.04 -25.93 31.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.454 ' CE1' ' HG2' ' A' ' 120' ' ' MET . 0.2 OUTLIER -96.46 26.3 4.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.161 -179.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -124.08 -70.12 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.893 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.99 10.37 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.71 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.417 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 3.3 t30 -107.19 -18.97 13.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.709 0.29 . . . . 0.0 111.214 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.17 37.97 2.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.847 0.356 . . . . 0.0 111.076 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.43 -46.49 2.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.806 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.66 10.43 16.79 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.849 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.432 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 5.1 m-85 -138.78 162.69 34.1 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.648 0.261 . . . . 0.0 110.779 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -118.21 124.54 73.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.883 0.373 . . . . 0.0 111.234 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -126.02 -164.9 1.36 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.798 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.413 ' HG ' HG22 ' A' ' 133' ' ' ILE . 6.7 mp -52.83 -30.45 33.57 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.172 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.91 -53.3 21.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.75 ' CB ' HG23 ' A' ' 112' ' ' ILE . 18.7 mp0 -72.73 -32.21 65.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.85 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.548 HD21 ' N ' ' A' ' 137' ' ' MET . 0.0 OUTLIER -56.8 -31.02 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.04 0.448 . . . . 0.0 110.548 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.9 tmmm? -54.57 -39.43 67.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.523 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.9 mt -50.26 -27.9 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.108 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.454 ' HG2' ' CE1' ' A' ' 104' ' ' PHE . 25.3 mtt -76.45 -31.7 57.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.923 HD12 HD11 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -68.59 -28.61 67.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.854 179.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.96 -31.33 12.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.995 0.426 . . . . 0.0 110.559 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.62 -28.77 61.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.871 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.499 ' OG1' HD23 ' A' ' 121' ' ' LEU . 0.4 OUTLIER -93.35 -62.85 1.29 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.87 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 57.65 25.08 54.96 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.977 -0.63 . . . . 0.0 113.011 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 127' ' ' THR . 1.2 pt-20 178.36 174.06 0.63 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 111.386 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.751 ' O ' HG23 ' A' ' 128' ' ' ILE . 10.2 t 51.63 36.56 17.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.199 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.751 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 178.63 -84.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.187 179.005 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.8 p 59.69 105.82 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.884 0.373 . . . . 0.0 111.146 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.412 ' H ' HD11 ' A' ' 121' ' ' LEU . 1.0 OUTLIER 69.33 -56.42 0.55 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.868 179.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -45.87 -29.31 1.33 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.67 0.272 . . . . 0.0 111.588 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.595 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.5 t0 -86.99 -26.66 23.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.801 0.334 . . . . 0.0 111.194 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.923 HD11 HD12 ' A' ' 121' ' ' LEU . 22.8 mm -64.48 -41.0 91.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.197 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -78.58 -27.49 45.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.321 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -86.02 -39.12 17.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.341 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 5.1 tp -66.63 -49.6 65.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.38 . . . . 0.0 111.074 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.548 ' N ' HD21 ' A' ' 117' ' ' LEU . 1.5 tmt? -45.6 -30.18 1.43 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -28.42 66.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.879 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -78.35 -48.83 14.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.937 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -54.94 -63.32 5.37 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.465 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -86.46 87.73 7.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.833 0.349 . . . . 0.0 110.913 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.81 27.45 4.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.964 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -111.4 -17.91 13.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.189 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 11.8 t30 67.64 50.62 0.88 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.935 0.398 . . . . 0.0 110.84 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.49 -42.39 3.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.824 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.5 -33.55 0.83 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.612 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.74 175.73 9.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 0.0 110.927 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.859 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.88 131.86 67.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.761 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.859 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.2 p30 -115.78 166.34 12.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.922 0.392 . . . . 0.0 111.483 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.716 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.5 t80 -47.4 90.24 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.517 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 33.7 t70 176.74 -66.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.845 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.6 mt-10 -70.09 -22.41 63.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.066 0.46 . . . . 0.0 109.792 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.842 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.8 OUTLIER -61.82 -34.21 75.52 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.822 179.269 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.716 HD21 ' CE1' ' A' ' 150' ' ' TYR . 5.6 mt -62.85 -18.89 63.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.532 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -78.62 -24.33 45.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.453 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -57.16 -62.56 1.67 Allowed 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.74 179.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.844 ' HG3' HD21 ' A' ' 97' ' ' LEU . 3.3 mtm -63.85 -31.58 72.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.93 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -42.92 -30.93 0.45 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.378 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -74.33 -33.6 56.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.393 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.687 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.1 t -55.47 -28.76 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.762 0.315 . . . . 0.0 111.191 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.904 179.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.806 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -154.12 147.18 24.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.865 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.49 164.73 11.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.92 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.749 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -72.65 154.3 7.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.858 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.548 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -114.58 -109.68 0.36 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.624 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -73.39 -7.25 50.88 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 122.194 -0.316 . . . . 0.0 111.283 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.749 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.7 mp -67.86 -38.85 83.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.171 0.51 . . . . 0.0 110.509 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.687 ' HA ' HG22 ' A' ' 160' ' ' VAL . 35.2 ttt-85 -56.27 -48.34 76.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.119 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.4 159.12 50.48 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.457 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt 60.71 29.0 18.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.727 0.299 . . . . 0.0 110.881 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.47 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.7 OUTLIER -128.88 29.01 5.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.863 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -113.4 -44.5 3.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.81 156.42 29.8 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.966 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.16 -43.63 0.14 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.455 2.103 . . . . 0.0 112.44 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 9.1 t -138.05 177.16 8.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.31 -52.93 59.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.827 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 21.4 ttp85 63.47 124.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.932 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -123.89 133.4 53.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.39 -35.07 8.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.481 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.845 0.355 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.22 81.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.38 135.85 13.65 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.5 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 59.63 31.56 21.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 m -122.47 32.0 5.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.855 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.492 ' HG3' HD13 ' A' ' 154' ' ' LEU . 1.1 mp0 -170.22 -40.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.772 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -58.1 -30.78 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.065 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.12 -51.37 69.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.879 HD22 ' CZ ' ' A' ' 153' ' ' PHE . 15.3 mt -75.31 -23.43 57.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.764 0.316 . . . . 0.0 110.797 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.48 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 3.9 t -53.53 -42.26 67.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.896 0.379 . . . . 0.0 110.47 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -74.84 -33.46 62.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.141 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.785 ' CD1' HD23 ' A' ' 97' ' ' LEU . 9.8 mt -60.76 -48.22 82.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.854 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 17.7 t80 -61.71 -41.53 97.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.808 0.337 . . . . 0.0 110.868 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -32.37 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.954 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 76.1 mtm -92.54 -29.7 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.926 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.449 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.6 OUTLIER -75.27 -38.04 60.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -75.59 63.61 1.56 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.945 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -21.83 62.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -69.26 -23.38 63.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.01 47.07 3.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.098 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.3 p-10 -116.38 -33.72 4.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.848 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.89 -32.28 5.02 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.451 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.479 ' CE2' ' HB2' ' A' ' 149' ' ' ASP . 3.2 m-85 -118.4 169.63 9.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.602 0.239 . . . . 0.0 110.719 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' CB ' ' A' ' 116' ' ' GLU . 10.4 mt -115.99 139.61 41.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-O 120.816 0.341 . . . . 0.0 110.728 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -117.39 -173.96 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.146 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.701 HD23 ' HG3' ' A' ' 134' ' ' GLU . 9.0 mp -59.15 -46.04 89.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.206 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -53.92 -24.76 17.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.288 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.556 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.9 mt-10 -89.09 -29.67 19.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.999 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.601 HD11 ' HB2' ' A' ' 137' ' ' MET . 90.6 mt -53.59 -22.67 8.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.86 0.362 . . . . 0.0 111.022 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -73.76 -26.4 60.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.193 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.529 HD12 ' CA ' ' A' ' 116' ' ' GLU . 8.2 mt -53.97 -56.79 7.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.51 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.518 ' SD ' HD21 ' A' ' 136' ' ' LEU . 2.3 ptp -51.67 -28.87 15.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.788 0.328 . . . . 0.0 111.218 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.493 HD13 ' CD1' ' A' ' 133' ' ' ILE . 0.3 OUTLIER -76.19 -28.64 57.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.909 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.37 -21.89 60.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.916 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.13 61.01 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.284 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.772 HG23 ' H ' ' A' ' 126' ' ' GLU . 15.4 t -90.27 -30.44 17.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 77.02 22.95 70.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.578 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.772 ' H ' HG23 ' A' ' 124' ' ' THR . 36.8 mt-10 -99.11 79.11 2.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.861 0.363 . . . . 0.0 110.875 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -58.02 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.856 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.491 HD11 HD13 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -45.78 -86.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.363 -179.806 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 131' ' ' ASP . 9.1 t -177.9 35.19 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.632 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 63.69 -72.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.1 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 129' ' ' THR . 5.4 m-20 -47.87 -38.16 15.63 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.936 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.473 ' CB ' HD12 ' A' ' 128' ' ' ILE . 0.5 OUTLIER -63.35 -33.08 74.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.342 179.53 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.493 ' CD1' HD13 ' A' ' 121' ' ' LEU . 2.2 mm -55.34 -43.05 69.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.701 ' HG3' HD23 ' A' ' 114' ' ' LEU . 1.2 mp0 -62.45 -39.81 94.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.232 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -57.76 -30.77 65.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.058 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.518 HD21 ' SD ' ' A' ' 120' ' ' MET . 6.7 tp -65.5 -46.19 80.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.938 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.601 ' HB2' HD11 ' A' ' 117' ' ' LEU . 6.7 tpt -43.04 -30.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.439 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -30.04 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.976 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.429 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 4.2 t0 -74.99 -53.7 8.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.835 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.25 -72.64 0.82 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.184 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.73 81.55 0.44 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.855 0.36 . . . . 0.0 110.798 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -105.56 31.42 4.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.935 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -113.24 2.68 15.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.366 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 60.34 32.47 20.7 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.78 0.324 . . . . 0.0 110.929 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -115.5 -38.51 3.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.872 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 108.88 22.85 6.73 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.582 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.62 142.92 22.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.749 0.309 . . . . 0.0 110.921 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.832 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -125.97 135.46 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.891 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.751 ' N ' HD13 ' A' ' 148' ' ' ILE . 12.0 t0 -115.56 173.14 6.69 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.287 0.565 . . . . 0.0 112.011 -179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.48 ' CE1' ' HA ' ' A' ' 98' ' ' SER . 6.8 t80 -42.84 -31.86 0.54 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.76 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 59.6 t0 -67.07 -70.61 0.24 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.615 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -56.14 -23.61 35.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.895 0.378 . . . . 0.0 110.692 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.879 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.8 t80 -56.97 -40.18 76.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.702 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.671 ' HA ' HD13 ' A' ' 97' ' ' LEU . 9.6 mt -61.65 -19.09 61.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.944 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 3.4 tp10 -68.8 -29.41 67.76 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.989 0.423 . . . . 0.0 110.629 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.464 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.57 -63.73 1.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.11 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.762 ' HG3' HD21 ' A' ' 97' ' ' LEU . 6.2 mmt -73.44 -30.35 63.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.149 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.49 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.6 OUTLIER -45.79 -30.38 1.64 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.145 -179.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.25 -26.83 65.16 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.223 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.763 HG22 ' HG3' ' B' ' 135' ' ' ARG . 46.0 t -47.43 -34.0 3.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 0.0 111.309 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.884 180.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 60.87 111.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -101.74 -44.42 5.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.827 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' B' ' 131' ' ' ILE . 7.8 mm -87.55 140.48 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.022 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -144.03 -112.89 0.1 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.799 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.21 -11.08 60.64 Favored 'General case' 0 C--N 1.333 -0.139 0 O-C-N 122.204 -0.31 . . . . 0.0 111.05 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.48 ' CD1' ' CE2' ' B' ' 132' ' ' PHE . 6.4 mp -63.73 -40.34 96.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.025 0.44 . . . . 0.0 110.724 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.763 ' HG3' HG22 ' A' ' 160' ' ' VAL . 12.1 ttt180 -89.75 168.57 11.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.231 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 116.91 -136.25 12.58 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.671 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 mmtp -42.56 -26.99 0.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.751 0.31 . . . . 0.0 111.626 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -44.78 -27.84 0.56 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.63 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.54 ' HG2' HG12 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -92.26 -177.27 4.6 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.938 0.399 . . . . 0.0 111.01 179.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -158.2 127.73 3.23 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.587 179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 31.6 Cg_exo -59.17 -165.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.538 2.159 . . . . 0.0 112.401 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 142' ' ' THR . 8.2 m -158.41 31.23 0.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.836 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 13.2 mt 61.27 161.65 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.824 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.85 -67.59 0.21 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.994 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -118.82 102.19 8.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.941 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -50.35 -35.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.4 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.927 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.6 mtm . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.811 0.338 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -148.65 -59.59 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 153.53 147.83 4.74 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 60.78 30.36 19.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 110.911 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 4.7 p -84.39 -36.18 22.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -87.7 -30.1 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.923 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.22 -30.44 68.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.941 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.58 -64.63 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.853 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.639 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.7 mt -59.36 -28.01 66.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.37 -54.64 29.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.45 -9.02 58.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.925 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 100' ' ' LEU . 12.2 tp -78.08 -44.09 27.27 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.14 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.449 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 71.6 t80 -54.73 -39.24 68.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.793 0.33 . . . . 0.0 110.956 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -42.29 99.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.848 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.3 mtm -64.31 -38.89 92.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.99 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -77.42 -46.37 22.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.01 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -70.94 65.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.855 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -27.5 68.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.949 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -69.77 -29.3 66.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.84 71.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.102 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -129.69 -43.95 1.23 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 146.43 -31.83 1.52 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.438 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -137.63 -179.03 5.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 0.0 110.451 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.629 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.6 mt -116.15 137.41 49.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 111.093 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.69 -168.54 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.892 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.867 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.3 OUTLIER -59.94 -33.08 71.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.927 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.3 -60.29 3.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.816 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.629 ' CB ' HG23 ' A' ' 112' ' ' ILE . 44.8 mt-10 -62.04 -29.96 70.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.786 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.649 HD11 ' HG ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.53 -26.21 12.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.894 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.752 ' HA ' HD12 ' A' ' 133' ' ' ILE . 6.2 ttpp -64.63 -29.8 70.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.506 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.3 mt -54.1 -29.01 18.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.597 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.603 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -70.43 -35.95 73.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.779 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.679 HD13 ' HG1' ' A' ' 124' ' ' THR . 0.2 OUTLIER -59.57 -33.82 71.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.729 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.71 -26.65 9.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.866 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' B' ' 132' ' ' PHE . . . -75.43 -23.31 56.93 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.246 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.751 HG21 HD11 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -90.0 -45.82 8.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.739 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.03 -83.63 1.19 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.683 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.97 113.97 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.554 HG23 HG12 ' A' ' 128' ' ' ILE . 1.5 t 175.17 -36.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.718 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.751 HD11 HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -125.19 -82.29 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.811 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.48 HG22 HD11 ' A' ' 121' ' ' LEU . 3.7 p 60.82 145.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.01 0.433 . . . . 0.0 111.534 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.75 -78.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.478 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -47.68 -48.98 28.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.768 0.318 . . . . 0.0 111.153 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.666 ' CB ' HD12 ' A' ' 128' ' ' ILE . 23.1 t70 -66.18 -26.2 67.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.873 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.752 HD12 ' HA ' ' A' ' 118' ' ' LYS . 17.5 mm -60.82 -53.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.867 ' HG2' HD21 ' A' ' 114' ' ' LEU . 11.5 mt-10 -75.35 -23.13 57.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.251 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -42.14 38.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.31 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.805 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.2 tp -73.52 -35.73 65.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.953 0.406 . . . . 0.0 110.384 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -33.49 20.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -24.51 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.769 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.454 ' HB2' HD12 ' A' ' 136' ' ' LEU . 0.8 OUTLIER -83.74 -43.64 15.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.958 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -53.63 -58.26 12.95 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.412 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -81.36 -76.14 0.26 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.754 0.311 . . . . 0.0 110.865 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 19.0 ttpt 60.36 28.92 18.58 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -116.77 -0.55 12.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.31 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 66.14 25.95 10.68 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.787 0.327 . . . . 0.0 111.208 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -124.71 -39.06 2.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.802 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.98 49.22 2.3 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.588 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.416 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 39.4 mtm-85 -159.13 112.21 2.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.828 0.347 . . . . 0.0 111.006 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.684 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.75 117.2 54.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.547 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.8 p-10 -146.76 117.33 7.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.89 0.376 . . . . 0.0 111.997 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.518 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 54.07 -82.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.461 178.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 149' ' ' ASP . 2.0 t0 -35.68 -62.07 0.43 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.48 ' CB ' HG12 ' A' ' 148' ' ' ILE . 1.7 mt-10 -75.35 -29.64 60.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.119 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.684 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -57.5 -50.2 73.82 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.871 0.367 . . . . 0.0 110.869 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.633 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.5 mt -55.7 -21.6 19.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.97 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.58 -9.43 59.35 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.773 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.805 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 1.2 t80 -72.68 -47.8 44.33 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.002 0.429 . . . . 0.0 110.537 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.639 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -61.92 -25.79 67.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.27 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -39.34 24.33 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.821 0.343 . . . . 0.0 111.042 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.34 -27.15 65.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.2 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.912 HG22 ' HA ' ' B' ' 135' ' ' ARG . 42.9 t -56.45 -30.18 30.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.814 0.34 . . . . 0.0 111.152 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.815 0.34 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 63.01 143.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.38 -51.74 9.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.804 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.76 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.9 mm -59.61 155.06 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.852 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.724 ' CD1' HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -116.66 -111.52 0.35 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.534 -179.742 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -9.93 56.13 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 122.234 -0.291 . . . . 0.0 111.45 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.76 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.6 mp -64.56 -41.22 96.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.912 ' HA ' HG22 ' A' ' 160' ' ' VAL . 36.3 ttt180 -105.39 -41.59 5.47 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.738 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -67.24 158.88 50.45 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.446 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.2 mmmt 58.06 28.5 16.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.857 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.708 ' HB3' HG21 ' A' ' 160' ' ' VAL . 9.3 m-85 -133.62 -45.12 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.439 ' HB3' HG11 ' A' ' 160' ' ' VAL . 0.0 OUTLIER -75.6 100.24 4.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.912 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.1 OUTLIER -74.03 126.95 88.85 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.479 ' O ' HG23 ' B' ' 142' ' ' THR . 23.6 Cg_exo -64.05 -65.05 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.511 2.141 . . . . 0.0 112.224 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.479 HG23 ' O ' ' B' ' 141' ' ' PRO . 0.7 OUTLIER -161.24 -176.31 5.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.6 mp -87.09 135.4 33.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.893 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 ptt85 -128.22 153.36 47.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 60.04 178.54 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.882 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.701 ' O ' HG13 ' B' ' 146' ' ' VAL . 0.3 OUTLIER 49.3 23.91 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.949 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.84 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -155.27 120.59 4.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -84.99 0.14 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.608 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt 62.1 147.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.823 0.344 . . . . 0.0 110.911 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m 59.58 161.52 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 76.53 -54.84 0.58 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.301 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.27 -30.81 0.86 Allowed 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.786 0.327 . . . . 0.0 111.428 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.61 -55.74 31.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.676 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.0 mt -77.07 -27.48 54.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.547 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.425 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 1.5 t -50.8 -42.19 57.89 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.742 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.88 -23.23 31.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.793 179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.709 HD13 ' HE2' ' B' ' 138' ' ' PHE . 74.4 mt -72.12 -54.76 8.78 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.157 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.467 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 21.3 t80 -58.59 -38.9 78.93 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.844 0.354 . . . . 0.0 110.923 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -60.18 -33.02 71.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.6 mtm -92.35 -31.8 15.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.871 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -73.32 -43.03 61.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.801 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -81.9 66.83 7.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.859 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.34 -24.28 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.998 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -69.03 -29.01 67.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.843 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.16 54.93 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.068 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 p-10 -116.4 -33.64 4.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.005 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.37 -26.97 5.12 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.493 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -129.74 169.55 14.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.554 0.216 . . . . 0.0 110.632 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.577 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.3 mt -116.02 143.03 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.9 0.381 . . . . 0.0 111.201 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.726 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -127.32 -169.81 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.124 -179.776 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.784 HD23 ' CG2' ' A' ' 133' ' ' ILE . 0.1 OUTLIER -56.85 -41.51 78.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.342 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.1 -43.72 70.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.063 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.577 ' CB ' HG23 ' A' ' 112' ' ' ILE . 2.6 mt-10 -78.23 -29.44 48.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.807 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.726 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.0 mm? -52.74 -28.99 24.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.6 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.2 ttpp -59.63 -31.76 69.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.078 179.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.525 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.7 mt -54.18 -29.48 19.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.642 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' CD2' ' B' ' 134' ' ' LEU . 0.0 OUTLIER -70.47 -32.18 69.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.355 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.82 HD21 ' CG1' ' A' ' 128' ' ' ILE . 0.2 OUTLIER -65.96 -31.6 72.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.067 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -49.88 -30.43 10.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.013 0.435 . . . . 0.0 110.664 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.67 64.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.009 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.606 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.8 OUTLIER -95.76 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.133 -179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 73.49 22.15 78.82 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.633 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.634 ' C ' HD13 ' A' ' 128' ' ' ILE . 14.5 mt-10 -102.04 -159.15 0.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.535 0.207 . . . . 0.0 110.696 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.461 ' O ' HG23 ' A' ' 128' ' ' ILE . 4.0 m -82.64 80.52 8.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.949 0.404 . . . . 0.0 111.369 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.82 ' CG1' HD21 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -157.79 80.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.648 179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.2 p -115.19 131.54 56.89 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.408 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 68.76 -63.24 0.36 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.286 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.73 -52.0 25.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.11 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.431 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . 56.0 t0 -73.01 -20.96 60.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.981 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.784 ' CG2' HD23 ' A' ' 114' ' ' LEU . 8.9 mm -67.23 -51.26 55.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.936 0.398 . . . . 0.0 110.841 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.768 ' HG3' HD21 ' A' ' 114' ' ' LEU . 5.0 mt-10 -68.12 -28.94 67.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.137 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -49.12 52.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.291 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.52 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.0 tp -64.34 -48.6 74.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.979 0.419 . . . . 0.0 110.702 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -44.54 -30.75 0.94 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.342 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -54.93 -27.5 43.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.961 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -78.41 -50.33 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.906 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.405 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -58.75 -64.25 4.48 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.401 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -87.04 102.65 14.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.808 0.337 . . . . 0.0 110.796 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.57 33.67 4.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.963 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -116.33 7.81 14.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.227 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.8 t30 59.65 34.81 22.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.842 0.354 . . . . 0.0 111.002 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -115.48 -36.77 4.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.861 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.86 25.76 7.43 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.53 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -160.13 141.74 12.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.791 0.329 . . . . 0.0 110.96 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.733 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.93 127.17 73.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.7 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.692 ' N ' HD13 ' A' ' 148' ' ' ILE . 43.4 t0 -115.55 165.51 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 111.632 -179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.583 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -31.79 -56.49 0.29 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.363 -179.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -46.26 -44.85 16.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.423 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.512 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.9 mt-10 -83.58 -29.21 27.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.062 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.733 ' N ' HD11 ' A' ' 148' ' ' ILE . 5.5 t80 -60.15 -52.33 65.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.01 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 154' ' ' LEU . 2.0 mt -53.36 -21.93 6.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.115 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -73.29 -21.82 60.5 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.917 0.389 . . . . 0.0 110.334 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.52 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -58.7 -51.03 71.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.569 179.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.453 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.4 ptp -68.74 -29.42 67.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.412 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 157' ' ' MET . 1.5 mttt -47.75 -28.87 2.7 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.773 0.32 . . . . 0.0 111.185 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.21 66.43 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.034 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HG3' ' B' ' 135' ' ' ARG . 32.3 t -65.12 -23.63 33.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.706 0.289 . . . . 0.0 111.182 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.925 -179.921 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . 0.486 HG22 ' H ' ' B' ' 129' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.786 0.327 . . . . 0.0 111.206 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.486 ' H ' HG22 ' B' ' 128' ' ' THR . 17.3 mt-30 -153.2 84.72 1.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.979 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 14.5 mtmm -58.34 -23.63 57.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.935 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.454 HD13 ' HA ' ' B' ' 131' ' ' ILE . 8.2 mm -80.7 157.84 4.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.649 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.565 ' CE2' HG21 ' A' ' 124' ' ' THR . 41.6 p90 -179.56 121.71 0.07 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.512 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.83 -57.5 0.51 Allowed 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.098 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.541 HD12 ' H ' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -39.41 -54.92 1.85 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.102 0.477 . . . . 0.0 111.148 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HG3' HG22 ' A' ' 160' ' ' VAL . 13.1 ttp180 -57.46 -165.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.974 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.592 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 51.66 25.67 15.08 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.636 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -158.29 -37.55 0.07 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.224 0.535 . . . . 0.0 109.704 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.709 ' HE2' HD13 ' A' ' 100' ' ' LEU . 3.3 m-85 -75.05 59.0 0.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.805 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.35 -175.73 5.39 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.865 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.22 165.95 27.37 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.21 129.14 12.77 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.609 2.206 . . . . 0.0 112.184 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 34.1 p -132.02 -79.02 0.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.41 -49.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.862 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.24 -68.52 0.17 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.6 mtm-85 -82.29 101.33 10.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.799 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -140.97 -170.87 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.845 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.943 179.843 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.0 mtt . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -77.62 122.23 25.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.925 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 95.93 -156.16 21.33 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.51 -79.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 58.4 m -102.29 17.74 22.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.203 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.26 -25.38 10.62 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.815 0.341 . . . . 0.0 110.862 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.51 -28.93 69.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.963 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.21 -61.39 2.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.796 HD11 ' HG2' ' A' ' 157' ' ' MET . 3.8 mt -62.5 -35.7 80.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.942 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.12 -40.94 59.63 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.117 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -84.57 -28.6 26.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.011 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' B' ' 138' ' ' PHE . 52.8 mt -69.28 -38.61 78.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.052 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 150' ' ' TYR . 5.2 t80 -55.41 -59.64 4.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.323 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -28.6 66.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.5 tmm? -83.79 -27.98 28.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -83.88 -38.2 21.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.108 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -56.75 -67.38 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.88 6.86 5.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.601 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.419 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -107.96 -14.04 14.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.593 0.235 . . . . 0.0 111.229 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.56 33.0 5.3 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.795 0.331 . . . . 0.0 111.076 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -116.46 -46.88 2.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.825 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 110.88 20.88 6.98 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.799 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.2 OUTLIER -146.84 157.3 43.62 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.817 -0.225 . . . . 0.0 110.714 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.764 HG23 ' HB2' ' A' ' 116' ' ' GLU . 10.7 mt -117.7 129.77 73.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.931 0.396 . . . . 0.0 111.348 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -124.89 -172.94 2.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.721 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.432 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.9 mp -48.5 -27.7 2.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.384 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -70.72 -59.16 2.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.989 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.764 ' HB2' HG23 ' A' ' 112' ' ' ILE . 8.8 mp0 -69.01 -31.75 70.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.788 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.4 OUTLIER -55.43 -22.34 19.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.021 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 -27.62 64.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.165 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.411 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.3 mt -52.37 -64.33 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.633 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 ptp -45.83 -34.66 3.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.758 0.313 . . . . 0.0 111.4 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 1.003 HD21 HG22 ' A' ' 129' ' ' THR . 8.4 tt -81.7 -29.57 32.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.99 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -28.16 64.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.004 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.96 -32.86 74.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.112 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.762 HG21 HD11 ' A' ' 128' ' ' ILE . 5.2 t -94.16 -42.71 8.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.996 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.7 31.39 57.79 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.623 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.879 ' O ' HG23 ' A' ' 129' ' ' THR . 1.7 tp10 -83.67 -178.42 7.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.843 0.354 . . . . 0.0 110.954 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 10.5 t -60.62 -19.86 59.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.19 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.762 HD11 HG21 ' A' ' 124' ' ' THR . 22.1 pt -54.12 -23.31 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 1.003 HG22 HD21 ' A' ' 121' ' ' LEU . 44.4 p -45.87 147.66 0.93 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.391 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 56.26 43.77 25.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.008 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -174.93 -40.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.659 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.442 ' HB3' HD12 ' A' ' 121' ' ' LEU . 0.1 OUTLIER -74.52 -37.5 63.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.772 179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.788 HG23 ' HB3' ' A' ' 117' ' ' LEU . 1.8 mp -66.71 -32.1 56.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.051 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.4 -40.78 70.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.188 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -86.17 -34.56 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.415 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.444 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 9.3 tp -68.06 -49.24 62.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.18 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.415 ' SD ' HD23 ' A' ' 117' ' ' LEU . 9.5 tpt -45.4 -32.34 2.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.348 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.18 -30.41 68.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.88 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -68.54 -50.57 50.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.45 -61.64 7.25 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.397 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -93.88 76.0 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.379 . . . . 0.0 110.827 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -98.21 29.61 3.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -113.55 -13.16 12.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.268 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 66.59 54.5 0.86 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.954 0.407 . . . . 0.0 110.873 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -115.56 -41.5 3.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 152.63 -27.8 0.85 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.562 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -175.26 4.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.776 0.322 . . . . 0.0 110.854 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.756 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -115.79 128.82 72.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.731 179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.756 ' N ' HD13 ' A' ' 148' ' ' ILE . 2.8 p30 -115.93 174.21 6.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 111.679 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.481 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.3 t80 -52.2 89.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.242 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 2.0 t0 176.47 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.128 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.594 ' HB2' HD11 ' A' ' 148' ' ' ILE . 2.2 mt-10 -70.4 -25.01 63.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.874 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.466 ' O ' ' HB2' ' A' ' 156' ' ' PHE . 1.1 t80 -59.32 -30.76 68.59 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.198 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.481 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.0 mt -66.68 -23.67 66.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.531 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -78.07 -10.0 59.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.681 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.607 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -71.24 -56.6 5.71 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.444 179.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.796 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.2 ppp? -57.09 -26.68 60.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.332 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -38.24 19.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.82 0.343 . . . . 0.0 111.067 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.25 -30.15 70.29 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG22 ' HA ' ' B' ' 135' ' ' ARG . 47.6 t -59.85 -27.72 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.798 0.332 . . . . 0.0 111.093 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.91 -179.943 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.862 0.363 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -175.56 104.89 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -89.21 -31.35 17.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.066 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 8.4 mm -97.24 137.47 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 111.559 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.463 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.3 OUTLIER -146.74 -110.17 0.09 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.195 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.67 -12.52 61.7 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.885 0.374 . . . . 0.0 110.367 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.607 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.9 mp -58.89 -40.38 84.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.835 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.862 ' HA ' HG22 ' A' ' 160' ' ' VAL . 58.1 ttt-85 -56.13 -43.3 78.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.07 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.21 151.3 45.63 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.534 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? 63.18 32.9 14.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.662 ' HB3' HG21 ' A' ' 160' ' ' VAL . 12.2 m-85 -144.02 36.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.935 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.01 141.53 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.959 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.07 156.83 9.57 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.161 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.48 113.91 2.94 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.529 2.153 . . . . 0.0 112.457 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.02 35.94 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.3 98.9 8.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.96 -40.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.48 153.08 44.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.75 -32.13 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.458 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 17.2 ptt-85 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.891 179.993 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.3 tpp . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.855 0.359 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.99 172.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.912 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -137.93 74.09 0.41 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.524 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.91 177.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.748 0.309 . . . . 0.0 110.892 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.34 -68.39 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.952 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.65 -46.32 84.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.936 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.9 -31.49 71.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.44 -58.43 8.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.92 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.732 HD13 HD22 ' A' ' 154' ' ' LEU . 2.0 mt -61.18 -28.72 69.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.6 t -56.86 -37.46 71.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.829 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.37 -25.59 29.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.895 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.806 HD13 ' CE1' ' B' ' 138' ' ' PHE . 10.2 mt -71.7 -44.3 64.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.995 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -59.49 -48.61 81.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.223 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -58.3 -32.65 68.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.132 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -87.81 -30.45 20.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.015 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.4 t80 -73.22 -50.75 20.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.921 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -72.65 66.23 0.72 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.914 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.41 -20.78 64.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -69.05 -24.14 64.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 0.0 110.925 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.74 52.98 2.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.09 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -116.44 -37.79 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.9 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 124.63 -22.58 6.49 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.644 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' HB2' ' A' ' 149' ' ' ASP . 5.3 m-85 -131.9 168.85 17.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.615 0.245 . . . . 0.0 110.839 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.71 HG23 ' HB2' ' A' ' 116' ' ' GLU . 16.7 mt -116.13 137.85 48.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.857 0.36 . . . . 0.0 111.131 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -129.06 -172.6 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.755 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.604 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -51.96 -28.71 17.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.32 -58.57 4.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.871 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.71 ' HB2' HG23 ' A' ' 112' ' ' ILE . 15.1 mp0 -69.55 -35.16 75.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.744 HD21 ' HB3' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -51.64 -27.38 11.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.918 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -63.09 -29.14 70.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.729 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.593 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.5 mt -48.97 -65.83 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.557 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.641 ' HG3' HD12 ' A' ' 121' ' ' LEU . 4.3 ptp -56.21 -26.14 49.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.382 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.965 HD22 HD13 ' A' ' 133' ' ' ILE . 10.4 mp -79.9 -25.43 40.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.192 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -61.99 -21.12 64.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.075 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.65 -33.58 66.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.43 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 121' ' ' LEU . 6.8 t -89.26 -44.26 10.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.831 0.348 . . . . 0.0 111.002 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 52.43 25.19 19.37 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.905 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.0 87.65 4.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.745 0.307 . . . . 0.0 110.786 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.898 ' O ' HG23 ' A' ' 129' ' ' THR . 63.1 m 60.26 -85.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.555 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.818 HG22 ' CB ' ' A' ' 132' ' ' ASP . 1.6 pt 35.52 -85.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.898 HG23 ' O ' ' A' ' 127' ' ' THR . 61.9 p 54.75 -171.93 0.05 Allowed 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -40.91 -30.33 0.13 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 111.265 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -57.39 -55.43 34.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.818 ' CB ' HG22 ' A' ' 128' ' ' ILE . 10.7 t70 -74.67 -23.52 58.66 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.73 0.3 . . . . 0.0 111.173 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.965 HD13 HD22 ' A' ' 121' ' ' LEU . 3.5 mm -66.17 -49.12 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.035 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -68.12 -25.86 65.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.304 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -47.23 11.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.215 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.821 HD21 HD21 ' B' ' 134' ' ' LEU . 6.3 tp -61.93 -46.73 88.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.956 0.407 . . . . 0.0 110.894 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 5.4 tpt -44.31 -30.52 0.83 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.302 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.62 -28.9 50.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.856 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.31 -52.37 10.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.888 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.97 -66.21 2.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.338 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -85.16 99.19 10.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.817 0.342 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -120.44 33.9 5.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.928 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -118.42 9.2 12.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.226 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 70.04 0.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.028 0.442 . . . . 0.0 110.941 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -155.48 -47.06 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.845 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.95 5.42 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.662 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -149.77 133.07 16.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.828 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.92 131.29 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.561 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.741 ' N ' HD13 ' A' ' 148' ' ' ILE . 36.2 t70 -115.61 164.16 14.74 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.019 0.437 . . . . 0.0 111.953 -178.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.804 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -32.78 -38.55 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.208 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.6 -65.52 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.794 0.33 . . . . 0.0 110.726 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.566 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.2 mt-10 -62.16 -25.31 67.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.843 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.828 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -57.48 -40.99 79.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.702 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.804 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.3 mt -61.96 -18.52 60.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.01 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -74.8 -17.67 60.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.439 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -68.25 -59.86 2.89 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.701 179.789 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.648 ' HG2' HD11 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -55.48 -26.02 40.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.252 -179.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.19 -29.33 3.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.819 0.342 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -71.61 -30.64 66.18 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.017 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.919 HG22 ' HA ' ' B' ' 135' ' ' ARG . 53.1 t -56.86 -29.16 29.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.36 . . . . 0.0 111.127 179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.95 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.876 0.37 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.0 -57.25 0.38 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.875 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.4 mmpp? -121.7 128.27 51.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.507 HG21 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 58.37 163.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.025 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -141.39 -116.43 0.12 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -66.07 -14.23 61.38 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 122.207 -0.308 . . . . 0.0 110.95 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.821 HD21 HD21 ' A' ' 136' ' ' LEU . 6.1 mp -59.38 -40.45 86.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.919 ' HA ' HG22 ' A' ' 160' ' ' VAL . 19.3 ttp180 -64.33 -47.28 79.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.021 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.32 151.03 46.34 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.513 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.73 33.14 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.842 0.353 . . . . 0.0 110.759 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.806 ' CE1' HD13 ' A' ' 100' ' ' LEU . 14.1 m-85 -145.08 31.05 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.828 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 8.7 mtmt -116.21 158.51 23.19 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.96 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.07 168.48 9.16 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.102 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -67.84 173.71 8.76 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.549 2.166 . . . . 0.0 112.214 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 11.9 p 55.33 102.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.118 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 2.3 mt -107.95 105.23 14.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.886 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 14.4 mtt85 60.61 90.19 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -165.78 -44.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.54 HG13 ' N ' ' B' ' 147' ' ' ARG . 0.4 OUTLIER 54.28 173.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.336 179.889 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.54 ' N ' HG13 ' B' ' 146' ' ' VAL . 23.7 mtp180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.862 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.788 0.328 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.05 131.84 1.65 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.856 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.63 -65.91 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.52 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -167.94 37.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.846 0.355 . . . . 0.0 110.968 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 m -74.22 -47.65 34.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.907 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -99.71 -27.67 13.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.978 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -59.12 -30.8 68.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.95 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -59.91 -64.32 0.99 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.788 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 100' ' ' LEU . 29.9 mt -66.75 -23.18 66.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.978 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.9 m -53.66 -47.11 70.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.267 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.59 -18.28 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.575 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.91 HD23 HD23 ' A' ' 97' ' ' LEU . 10.0 tp -72.12 -35.2 69.09 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.11 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.447 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 28.4 t80 -65.3 -50.15 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.873 0.368 . . . . 0.0 110.825 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.3 mtp85 -59.8 -51.31 70.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.7 -30.08 67.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 3.2 t80 -83.18 -38.09 22.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -78.7 67.08 4.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.851 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -24.94 59.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.94 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -69.41 -24.55 63.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.83 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.77 61.49 0.8 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.065 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -118.65 -41.41 2.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 130.9 -26.42 4.01 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.531 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -139.59 -176.67 4.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.614 0.245 . . . . 0.0 110.501 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.556 HG23 ' HB3' ' A' ' 116' ' ' GLU . 7.0 mt -115.92 126.82 73.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 121.034 0.445 . . . . 0.0 111.135 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.39 -167.74 1.37 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.956 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.589 ' HA ' HD12 ' A' ' 117' ' ' LEU . 9.3 mp -55.25 -59.06 5.31 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -54.77 -32.03 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.97 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.571 ' O ' HD12 ' A' ' 119' ' ' ILE . 19.6 tt0 -79.12 -35.82 41.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.76 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.809 HD23 ' HE1' ' A' ' 120' ' ' MET . 2.1 mt -57.65 -25.55 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.638 ' HG2' HD11 ' A' ' 121' ' ' LEU . 8.5 ttpt -68.62 -8.36 41.41 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.536 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.571 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.4 mt -75.96 -39.42 37.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.809 ' HE1' HD23 ' A' ' 117' ' ' LEU . 5.0 ptp -61.91 -43.2 99.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.633 0.254 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 122' ' ' GLN . 4.3 pp -67.99 -31.02 70.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.786 0.327 . . . . 0.0 110.582 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.731 ' N ' HD12 ' A' ' 121' ' ' LEU . 15.5 mm-40 -58.93 -31.19 68.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.445 . . . . 0.0 110.122 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.26 -25.91 66.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.832 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.68 HG21 ' HB2' ' B' ' 132' ' ' PHE . 0.6 OUTLIER -93.42 -51.9 4.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.93 -179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 111.99 -27.58 10.14 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.445 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -71.01 93.72 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 110.834 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 6.7 m -63.08 86.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.006 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.494 HD12 ' CB ' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -47.67 -84.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.31 -179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.659 HG23 ' H ' ' A' ' 132' ' ' ASP . 5.0 t 178.73 177.95 0.45 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.567 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.25 7.16 17.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.437 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 129' ' ' THR . 8.0 t0 -112.94 -34.37 5.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.737 0.303 . . . . 0.0 110.852 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.659 ' H ' HG23 ' A' ' 129' ' ' THR . 19.9 m-20 -64.52 -30.15 71.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.9 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.581 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.0 mt -72.9 -36.25 51.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.235 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.84 -30.52 62.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.052 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -43.63 59.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.965 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 136' ' ' LEU . 8.9 tp -59.89 -44.55 94.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.477 ' CG ' HD11 ' A' ' 117' ' ' LEU . 0.7 OUTLIER -44.24 -30.98 0.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.403 -179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -30.71 66.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -77.66 -54.64 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.004 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.411 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.59 -69.37 1.05 Allowed Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.57 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -71.11 -70.54 0.3 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.702 0.287 . . . . 0.0 110.734 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.7 tttp 51.57 30.41 6.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.595 179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -132.26 10.45 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.437 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 32.2 t30 53.27 41.64 32.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.827 0.346 . . . . 0.0 111.086 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -115.38 -33.38 5.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.01 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.94 27.25 34.83 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.308 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HB2' ' CD2' ' A' ' 111' ' ' TYR . 31.6 ptt180 -160.18 118.48 2.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.808 0.337 . . . . 0.0 110.925 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.77 122.81 70.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.66 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.695 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.7 p-10 -151.99 134.27 15.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.097 0.475 . . . . 0.0 112.277 -179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 42.16 -85.45 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.278 -0.873 . . . . 0.0 112.887 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 149' ' ' ASP . 4.7 m-20 -35.85 -55.84 0.72 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.833 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 6.6 mt-10 -83.6 -25.17 31.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.86 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.7 t80 -61.03 -48.77 80.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.92 0.39 . . . . 0.0 110.904 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.829 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.4 mt -58.73 -19.3 38.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.123 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -76.0 -25.08 55.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.816 0.341 . . . . 0.0 110.626 179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.489 ' CE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -55.09 -60.24 3.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.664 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.835 ' CG ' HD11 ' A' ' 97' ' ' LEU . 9.2 mmt -63.27 -36.79 84.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.599 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.07 -28.99 0.79 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.0 -28.63 71.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.522 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.678 HG13 ' HG3' ' B' ' 135' ' ' ARG . 59.5 t -53.09 -31.43 17.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 0.0 111.197 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.169 -0.919 . . . . 0.0 110.966 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.792 0.33 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -126.88 28.64 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.941 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt 59.02 34.85 23.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.064 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.699 HD12 ' HB2' ' B' ' 135' ' ' ARG . 9.3 mm -94.24 135.02 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.906 0.384 . . . . 0.0 111.215 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.68 ' HB2' HG21 ' A' ' 124' ' ' THR . 0.4 OUTLIER -150.33 -110.09 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.913 179.382 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.55 ' HB2' HG23 ' A' ' 124' ' ' THR . 1.4 t0 -81.77 30.65 0.37 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.939 0.4 . . . . 0.0 110.495 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 120' ' ' MET . 7.4 mp -113.69 -39.6 3.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.405 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.699 ' HB2' HD12 ' B' ' 131' ' ' ILE . 6.5 ttp180 -93.99 -63.31 1.21 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.21 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -59.44 134.77 51.66 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.214 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt 79.01 21.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.933 0.396 . . . . 0.0 110.502 -179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.574 ' HE2' HD21 ' A' ' 100' ' ' LEU . 92.1 m-85 -134.54 28.4 3.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.331 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.629 ' HG2' HG11 ' A' ' 160' ' ' VAL . 0.1 OUTLIER -154.64 127.6 8.23 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.729 -179.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.69 139.87 2.58 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.045 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -85.65 80.67 1.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.586 2.191 . . . . 0.0 112.423 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.09 142.78 51.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.986 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 27.9 mt -146.82 -47.33 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -128.53 146.29 50.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.874 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 11.8 mtm180 -129.25 128.97 44.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.62 164.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.44 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.89 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 15.4 mmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.777 0.323 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -61.16 -34.7 75.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.33 -126.57 2.12 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.505 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.1 mptt 60.26 103.86 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.824 0.345 . . . . 0.0 110.895 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 68.97 9.61 7.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.431 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.71 -28.25 4.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.753 0.311 . . . . 0.0 110.897 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -69.81 -28.83 66.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.974 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.442 ' HB3' ' CE1' ' B' ' 138' ' ' PHE . 1.3 mm-40 -58.34 -42.71 87.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.95 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.5 mt -82.91 -34.02 26.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.815 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -53.12 -42.77 66.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.598 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.95 -28.87 35.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.534 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.668 HD12 ' CE2' ' B' ' 138' ' ' PHE . 12.2 mt -83.09 -2.47 55.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.255 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.8 t80 -91.55 -52.9 4.55 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.863 0.363 . . . . 0.0 110.844 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -56.58 20.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 2.7 tpp -56.48 -21.66 27.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.327 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.441 ' O ' HD13 ' A' ' 119' ' ' ILE . 2.5 t80 -86.05 -40.42 15.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.132 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -67.35 -74.05 0.12 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.147 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.52 7.8 5.86 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.689 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -101.84 -3.49 27.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.533 0.206 . . . . 0.0 111.466 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.24 29.51 15.91 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.812 0.339 . . . . 0.0 111.217 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -116.49 -46.83 2.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.774 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.408 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 103.39 20.01 11.62 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.812 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -141.34 157.16 45.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.598 0.237 . . . . 0.0 110.786 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.618 HG23 ' CB ' ' A' ' 116' ' ' GLU . 8.7 mt -116.43 132.45 66.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.253 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.703 ' O ' HD23 ' A' ' 117' ' ' LEU . 5.7 m-20 -117.41 177.97 4.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.898 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 134' ' ' GLU . 9.0 mt -51.48 -31.55 23.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.305 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.89 -45.13 68.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.716 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.618 ' CB ' HG23 ' A' ' 112' ' ' ILE . 9.1 mt-10 -69.45 -24.09 63.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.83 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.703 HD23 ' O ' ' A' ' 113' ' ' ASP . 3.9 mm? -56.69 -21.04 24.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.866 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -75.51 -24.28 56.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.746 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.589 HD12 ' CA ' ' A' ' 116' ' ' GLU . 7.2 mt -56.99 -59.29 3.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.207 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.733 ' SD ' HD21 ' B' ' 134' ' ' LEU . 12.4 ptp -43.74 -39.36 3.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.684 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 128' ' ' ILE . 18.4 mt -58.86 -43.89 90.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.129 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -53.9 -25.59 20.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.871 0.367 . . . . 0.0 110.751 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 120' ' ' MET . . . -69.32 -35.57 76.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.09 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.9 t -93.32 -43.34 8.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.96 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.22 -30.86 8.72 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.572 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.421 ' O ' HD22 ' A' ' 121' ' ' LEU . 1.9 pt-20 -57.85 112.8 1.6 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.85 0.357 . . . . 0.0 110.936 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 81.6 m -69.37 104.4 2.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.265 0.555 . . . . 0.0 110.832 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.668 HD12 HD21 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -91.7 154.93 3.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.609 -179.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.471 HG23 ' H ' ' A' ' 132' ' ' ASP . 2.3 t -80.28 159.73 25.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.834 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -57.19 -22.69 42.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.817 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.49 -48.72 54.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.006 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.655 ' HB3' HD13 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -63.76 -29.93 71.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.834 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.642 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -79.36 -40.89 22.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.056 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' A' ' 114' ' ' LEU . 4.5 tt0 -72.95 -32.13 65.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.76 -27.92 44.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.032 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.569 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 7.9 tp -70.34 -49.87 44.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.041 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.641 ' SD ' HD21 ' A' ' 117' ' ' LEU . 13.5 tpt -44.17 -30.97 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 mttm -55.04 -27.49 45.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.946 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.2 -50.98 13.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.918 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.403 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -53.64 -65.69 3.25 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -84.45 82.17 8.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.864 0.364 . . . . 0.0 110.918 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -97.19 26.83 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.954 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -111.39 -17.43 13.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 66.81 52.18 0.97 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.938 0.399 . . . . 0.0 110.735 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -115.54 -44.31 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 156.29 -26.08 0.54 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.707 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.01 -179.33 8.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.902 0.382 . . . . 0.0 111.091 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.724 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 131.28 68.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.761 179.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.724 ' N ' HD13 ' A' ' 148' ' ' ILE . 5.1 p-10 -115.8 169.64 9.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.352 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.609 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.5 t80 -51.73 88.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.231 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.6 OUTLIER 175.96 -68.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.029 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.85 -26.3 65.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.797 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -59.33 -35.83 74.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.144 179.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.609 HD21 ' CE1' ' A' ' 150' ' ' TYR . 6.3 mt -59.71 -21.12 60.2 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.444 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 35.3 mt-10 -71.14 -32.25 68.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.967 0.413 . . . . 0.0 110.505 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.569 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -53.68 -64.1 0.93 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.971 179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.772 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.7 mmt -67.66 -33.43 74.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.614 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -47.98 -29.07 3.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.643 179.695 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -66.67 -27.56 73.3 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.18 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.795 HG22 ' HG3' ' B' ' 135' ' ' ARG . 96.2 t -44.74 -36.28 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 120.85 0.357 . . . . 0.0 111.272 179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.875 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.788 0.328 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.32 38.19 10.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.451 ' HB3' HD13 ' A' ' 136' ' ' LEU . 8.1 mtmm -114.65 -41.95 3.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mm -100.44 148.47 6.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -153.03 -97.91 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 179.437 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.51 -21.31 58.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.094 0.473 . . . . 0.0 110.288 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.733 HD21 ' SD ' ' A' ' 120' ' ' MET . 3.4 mp -55.22 -52.23 64.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.659 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.8 OUTLIER -67.99 -47.33 68.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.39 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' B' ' 138' ' ' PHE . . . -50.79 173.35 0.11 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.215 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt 69.28 -62.93 0.39 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.032 0.444 . . . . 0.0 110.242 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.668 ' CE2' HD12 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -41.01 -34.86 0.46 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.685 179.707 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -86.0 148.08 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.93 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.26 132.73 6.81 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.726 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -57.16 -162.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.491 2.127 . . . . 0.0 112.29 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.584 ' OG1' HD12 ' B' ' 143' ' ' LEU . 16.8 p -95.7 -50.24 5.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.988 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.584 HD12 ' OG1' ' B' ' 142' ' ' THR . 1.7 mp -135.39 141.97 45.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -109.73 159.75 16.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.877 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 45.8 mtt180 60.54 170.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -146.81 -48.63 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.825 0.345 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.25 83.41 6.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 136.78 102.67 0.64 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.549 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -161.07 118.84 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.827 0.346 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 m -176.84 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.84 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.582 ' HG3' HD13 ' A' ' 154' ' ' LEU . 0.0 OUTLIER -91.24 -22.92 20.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.99 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -55.56 -35.27 65.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.083 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -58.97 -50.07 75.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.879 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.884 HD21 ' CG ' ' A' ' 157' ' ' MET . 11.6 mt -73.04 -29.86 63.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.656 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.409 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -49.21 -54.79 14.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.507 179.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -78.85 -19.15 52.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.414 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.773 HD23 HD23 ' A' ' 97' ' ' LEU . 14.5 tp -66.65 -48.36 69.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.037 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.49 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.2 t80 -58.09 -51.17 70.81 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 0.0 110.825 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -57.8 -35.02 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ttp -86.83 -18.66 30.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.44 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.474 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.7 t80 -90.67 -49.27 6.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.195 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.12 -75.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.038 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.73 8.8 5.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.668 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -103.38 -11.44 17.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.36 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 35.73 10.02 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.823 0.344 . . . . 0.0 111.035 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.0 p-10 -116.46 -45.28 2.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.805 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 109.42 5.69 29.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.978 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.1 m-85 -141.65 161.22 38.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.768 0.284 . . . . 0.0 110.71 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.821 HG23 ' HB3' ' A' ' 116' ' ' GLU . 17.2 mt -116.36 142.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-O 121.017 0.437 . . . . 0.0 111.334 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.33 -168.5 1.81 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.796 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.618 HD23 HG22 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -60.85 -30.41 70.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -68.64 -57.37 5.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.821 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -61.29 -34.14 74.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.984 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.726 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.1 -25.5 13.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.026 179.925 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -67.24 -20.8 65.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.821 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 116' ' ' GLU . 6.2 mt -58.88 -58.96 4.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.226 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 13.3 ptp -55.02 -32.64 61.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.278 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.727 ' O ' HD22 ' A' ' 121' ' ' LEU . 0.7 OUTLIER -59.25 -41.34 88.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.812 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.401 ' N ' HD13 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -52.06 -25.59 9.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.113 179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.36 -24.35 62.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.532 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.533 ' CG2' HD22 ' A' ' 121' ' ' LEU . 6.9 t -104.91 -40.71 5.84 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 61.52 28.0 68.9 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.885 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.514 ' O ' HG23 ' A' ' 128' ' ' ILE . 12.2 pt-20 -103.96 43.17 1.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.953 0.406 . . . . 0.0 110.646 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.689 ' O ' HG23 ' A' ' 129' ' ' THR . 98.8 m 61.62 -103.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.33 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 121' ' ' LEU . 6.3 pt 39.47 29.85 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 127' ' ' THR . 47.1 p -93.54 142.05 27.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.297 -179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.24 -61.36 0.46 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.896 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.11 -57.45 12.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.29 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.21 -39.66 39.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.831 0.348 . . . . 0.0 111.115 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.726 HG23 ' HB3' ' A' ' 117' ' ' LEU . 8.0 mt -56.14 -31.68 32.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.196 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.28 -29.12 57.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.009 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -86.03 -39.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.045 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.521 HD21 ' CD2' ' B' ' 134' ' ' LEU . 9.0 tp -63.24 -48.16 79.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.977 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -43.35 -31.03 0.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.429 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.4 -30.85 61.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.928 0.394 . . . . 0.0 110.709 179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -69.5 -51.35 36.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.644 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.46 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -57.36 -66.34 2.91 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.12 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -83.81 95.37 8.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.858 0.361 . . . . 0.0 110.748 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.03 33.08 5.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.923 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -115.0 5.73 15.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.276 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 60.25 42.27 15.39 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 111.006 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -119.5 -42.58 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.825 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.22 15.41 7.16 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.812 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.443 ' HD3' ' CD2' ' A' ' 111' ' ' TYR . 11.4 mtt85 -155.26 150.89 27.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.865 0.364 . . . . 0.0 110.948 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.794 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.87 129.43 72.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.575 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.734 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.0 p30 -115.77 166.37 12.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.122 0.487 . . . . 0.0 111.955 -179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 149' ' ' ASP . 0.1 OUTLIER -27.5 -55.01 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.653 -179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -47.89 -59.8 3.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.627 -179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.56 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.3 mt-10 -68.9 -25.91 64.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.349 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.794 ' N ' HD11 ' A' ' 148' ' ' ILE . 6.5 t80 -58.81 -52.83 64.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.939 0.399 . . . . 0.0 110.82 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.778 ' HA ' HD13 ' A' ' 97' ' ' LEU . 7.9 mt -58.32 -19.15 32.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.161 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 11.6 tm-20 -70.78 -27.83 64.21 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.854 0.359 . . . . 0.0 110.902 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.671 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.3 OUTLIER -56.65 -58.98 5.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.28 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.884 ' CG ' HD21 ' A' ' 97' ' ' LEU . 8.8 mmt -78.73 -30.33 45.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.035 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.9 OUTLIER -45.21 -29.85 1.06 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.007 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -75.28 -28.38 62.07 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.263 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.676 HG13 ' CG ' ' B' ' 135' ' ' ARG . 39.8 t -45.48 -33.17 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.845 0.355 . . . . 0.0 111.402 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.888 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.793 0.33 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -60.29 118.63 6.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.86 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -165.08 -43.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.427 HD13 ' HA ' ' B' ' 131' ' ' ILE . 8.1 mm -87.61 140.08 16.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.073 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.3 OUTLIER -143.37 -111.67 0.11 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.669 179.662 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -11.19 60.78 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.742 0.306 . . . . 0.0 110.854 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.671 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.2 mp -65.15 -41.83 94.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.736 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.676 ' CG ' HG13 ' A' ' 160' ' ' VAL . 30.3 ttt180 -81.57 -46.84 13.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.899 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.47 145.61 41.91 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.84 28.14 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.761 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' A' ' 157' ' ' MET . 71.5 m-85 -146.24 30.6 1.03 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.837 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.54 ' HG3' HG11 ' A' ' 160' ' ' VAL . 2.4 mttt -95.81 -43.75 7.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.934 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.8 153.14 42.27 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.72 -34.11 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 5.2 m 63.68 140.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.895 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.44 164.12 15.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.955 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -144.94 31.36 1.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.88 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -72.89 -70.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.78 131.46 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.423 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.906 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.886 0.374 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.6 109.32 15.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.1 139.09 3.51 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.475 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.53 75.73 1.51 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.807 0.336 . . . . 0.0 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 67.71 -71.24 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.964 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.42 -42.1 10.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.949 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -59.11 -29.64 67.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.972 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -58.11 -57.2 13.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.972 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.789 ' HA ' HD12 ' A' ' 100' ' ' LEU . 1.1 mt -61.51 -31.28 71.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.84 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 11.5 m -48.07 -46.72 33.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.032 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.6 -24.19 56.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.717 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.789 HD12 ' HA ' ' A' ' 97' ' ' LEU . 50.9 mt -72.54 -49.93 29.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.031 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 41.0 t80 -61.43 -55.68 28.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.999 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -24.84 13.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.258 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 21.4 ttp -92.31 -28.41 16.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.033 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.412 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.7 t80 -83.22 -43.02 16.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.064 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -70.19 65.92 0.27 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.952 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.07 -22.73 65.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.09 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -69.59 -27.36 65.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.942 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.01 78.09 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.053 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -142.63 -46.48 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.02 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 144.49 -26.97 1.97 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.519 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.99 -175.68 4.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 110.542 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 116' ' ' GLU . 14.7 mt -115.8 130.43 70.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.856 0.36 . . . . 0.0 110.851 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -117.37 -176.59 3.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.039 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.942 HD13 HD12 ' A' ' 117' ' ' LEU . 2.4 mm? -51.71 -47.34 63.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.445 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -55.7 -29.41 59.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.128 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.752 ' HB3' HG23 ' A' ' 112' ' ' ILE . 0.8 OUTLIER -86.93 -26.9 23.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.853 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.942 HD12 HD13 ' A' ' 114' ' ' LEU . 82.9 mt -54.73 -32.46 59.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.87 0.366 . . . . 0.0 110.656 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.85 -34.68 63.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.339 179.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.518 HD12 ' O ' ' A' ' 116' ' ' GLU . 9.8 mt -56.8 -29.14 29.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.949 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 15.3 mmt -61.61 -48.15 82.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.674 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.528 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -75.53 -33.46 60.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.778 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.22 -27.65 6.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.932 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.84 -25.27 44.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.115 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.526 HG21 HG21 ' A' ' 127' ' ' THR . 0.8 OUTLIER -96.83 -59.32 1.83 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.888 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.02 -30.45 8.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.454 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -172.2 75.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 110.756 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.583 ' O ' HD13 ' A' ' 128' ' ' ILE . 1.2 t -113.92 -45.14 3.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.985 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.724 HG22 HG22 ' A' ' 129' ' ' THR . 32.7 mm -132.54 -78.37 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.228 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.724 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 166.7 174.37 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.354 -179.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -56.38 -22.79 33.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.997 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -66.65 -49.46 66.12 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.104 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.437 ' OD2' HG21 ' A' ' 128' ' ' ILE . 1.2 t70 -52.18 -29.74 23.71 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.142 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.528 HD11 ' HB2' ' A' ' 121' ' ' LEU . 2.6 mt -63.86 -39.62 86.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.06 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -78.97 -31.62 45.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -78.02 -28.7 49.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.791 HD21 HD21 ' B' ' 134' ' ' LEU . 11.0 tp -64.78 -48.22 75.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.865 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.414 ' HE1' ' HA2' ' A' ' 146' ' ' GLY . 0.0 OUTLIER -42.27 -31.85 0.44 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.387 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.97 -29.17 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.768 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.434 ' HB3' ' CE1' ' A' ' 156' ' ' PHE . 0.4 OUTLIER -79.11 -39.19 34.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.645 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -73.34 -48.37 19.13 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.257 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -110.55 129.18 55.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.8 0.333 . . . . 0.0 110.76 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -142.23 33.22 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -123.92 14.61 9.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.221 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.86 28.07 9.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.81 0.338 . . . . 0.0 111.185 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -115.79 -38.04 3.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.863 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.414 ' HA2' ' HE1' ' A' ' 137' ' ' MET . . . 89.56 47.38 4.03 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.451 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -148.07 110.63 4.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.792 0.33 . . . . 0.0 111.009 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.768 HD11 ' CA ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.84 112.24 38.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.44 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 151' ' ' ASP . 4.6 p-10 -139.12 112.88 8.44 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -179.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.459 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 52.36 -81.0 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.627 178.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 149' ' ' ASP . 1.2 p30 -37.54 -53.24 1.19 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.457 ' CB ' HG12 ' A' ' 148' ' ' ILE . 19.2 mt-10 -82.18 -27.38 32.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.051 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.768 ' CA ' HD11 ' A' ' 148' ' ' ILE . 4.0 t80 -60.15 -49.04 79.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.935 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.669 HD22 HD13 ' A' ' 97' ' ' LEU . 3.1 mt -53.74 -21.06 6.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.354 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -23.42 59.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.513 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.512 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -61.99 -59.56 4.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.72 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.643 ' HG2' HD21 ' A' ' 97' ' ' LEU . 3.2 ppp? -64.17 -27.05 68.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -33.34 16.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.922 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -61.53 -36.53 92.73 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.084 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.816 HG21 ' HB2' ' B' ' 138' ' ' PHE . 57.7 t -57.36 -27.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 111.075 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.831 179.958 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.811 0.338 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -102.91 124.65 48.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.974 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 18.7 mtmm -146.21 -47.7 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.742 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.732 HG23 ' HB2' ' B' ' 134' ' ' LEU . 3.8 mm -71.09 154.38 7.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.761 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.507 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -110.62 -114.3 0.31 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.382 -0.372 . . . . 0.0 112.0 -179.431 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.53 -9.7 50.92 Favored 'General case' 0 C--O 1.232 0.149 0 O-C-N 122.158 -0.339 . . . . 0.0 111.799 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.791 HD21 HD21 ' A' ' 136' ' ' LEU . 5.7 mp -65.66 -40.58 92.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.049 0.452 . . . . 0.0 110.417 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.795 ' HG3' HG22 ' A' ' 160' ' ' VAL . 0.2 OUTLIER -107.77 -178.05 3.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.472 179.78 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.603 ' H ' ' HG2' ' B' ' 135' ' ' ARG . . . 69.55 18.01 73.32 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.517 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 24.2 mmtt -157.02 -38.67 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.302 0.573 . . . . 0.0 109.484 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.816 ' HB2' HG21 ' A' ' 160' ' ' VAL . 6.3 m-85 -72.07 61.25 0.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.459 179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.553 ' HG2' HG11 ' A' ' 160' ' ' VAL . 0.5 OUTLIER -122.39 172.6 8.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.153 -179.406 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.419 ' HB2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -58.94 159.37 13.72 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.915 179.903 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.419 ' HD2' ' HB2' ' B' ' 140' ' ' ARG . 89.3 Cg_endo -79.52 -38.12 0.43 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.282 1.988 . . . . 0.0 112.506 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.0 m -105.01 149.38 25.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.962 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.8 mt -103.93 -32.66 9.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 62.62 -80.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.051 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 26.4 ptt85 -88.64 105.23 17.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.997 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.21 142.19 3.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.399 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.856 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.7 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.788 0.328 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.0 mtpp -129.9 -52.37 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -150.89 -173.12 20.62 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.494 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -112.44 80.02 1.29 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.819 0.342 . . . . 0.0 110.864 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.2 t -171.89 -47.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.873 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.0 -30.74 15.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -58.97 -31.09 68.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -61.66 -61.69 2.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.827 HD21 ' HG3' ' A' ' 157' ' ' MET . 0.8 OUTLIER -67.72 -26.43 66.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.5 t -52.86 -43.31 65.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.871 0.367 . . . . 0.0 111.019 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.76 -38.19 19.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.951 HD13 ' HE1' ' A' ' 157' ' ' MET . 7.4 mt -61.23 -33.31 73.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 7.5 t80 -63.4 -60.87 2.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.062 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -28.48 64.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.213 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 13.0 ttm -79.51 -42.61 24.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.121 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.554 ' O ' HD13 ' A' ' 119' ' ' ILE . 1.9 t80 -74.37 -29.68 61.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.169 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.434 ' O ' ' CG ' ' A' ' 106' ' ' LYS . 32.0 t0 -66.67 -75.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.888 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.52 ' HD2' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER 84.86 -29.45 0.08 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.74 0.416 . . . . 0.0 111.428 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.44 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 2.2 m-20 -68.86 -23.73 64.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 69.43 39.67 1.58 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.0 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -116.49 -45.05 2.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.756 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.41 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 115.35 18.21 6.32 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.875 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.4 OUTLIER -148.44 159.51 43.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.667 0.234 . . . . 0.0 110.812 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.807 HG22 HD12 ' A' ' 117' ' ' LEU . 11.4 mt -119.72 137.75 52.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.927 0.394 . . . . 0.0 111.217 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.439 ' O ' HD13 ' A' ' 117' ' ' LEU . 16.9 m-20 -136.96 -168.05 2.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.759 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.94 -26.75 16.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.148 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -71.5 -53.23 14.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.003 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.775 ' CB ' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -70.66 -36.9 73.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.021 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.807 HD12 HG22 ' A' ' 112' ' ' ILE . 4.7 mp -52.7 -28.19 20.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.775 0.322 . . . . 0.0 110.504 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HA ' HD11 ' A' ' 133' ' ' ILE . 9.9 ttpt -57.55 -27.84 62.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.093 0.473 . . . . 0.0 110.072 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.554 HD13 ' O ' ' A' ' 104' ' ' PHE . 15.1 mt -64.1 -26.0 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.766 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.64 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -62.51 -48.6 78.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.82 179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.464 ' CD2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -71.83 -28.92 63.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.986 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.46 -25.89 52.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.77 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -78.05 -26.05 48.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.222 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.02 -58.43 2.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.959 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 107.17 -13.77 40.35 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.779 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' CB ' ' CD1' ' A' ' 128' ' ' ILE . 20.7 mt-10 -55.96 -171.57 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.733 0.301 . . . . 0.0 110.979 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.887 ' O ' HG23 ' A' ' 129' ' ' THR . 0.8 OUTLIER -84.55 -66.46 0.89 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.85 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 128' ' ' ILE . 0.0 OUTLIER 37.82 -93.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.794 -179.125 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.887 HG23 ' O ' ' A' ' 127' ' ' THR . 67.6 p 52.7 110.31 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.057 0.456 . . . . 0.0 111.806 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 72.12 -61.23 0.5 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.618 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -47.33 -35.46 8.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.618 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.413 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 59.2 t0 -97.73 -36.65 10.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.858 0.361 . . . . 0.0 110.97 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.728 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.9 mt -66.26 -32.22 57.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.231 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.47 -29.25 52.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.055 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -86.11 -45.01 11.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.104 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.5 tp -60.1 -41.56 92.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 3.7 tpt -46.6 -29.81 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.241 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.59 -31.24 71.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.792 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.6 -53.62 13.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.4 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -54.33 -67.72 2.03 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.42 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -85.22 98.85 10.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.806 0.336 . . . . 0.0 110.968 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -98.87 30.39 3.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -112.01 -12.56 13.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.294 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.4 t30 67.78 40.47 2.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -115.48 -38.02 3.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.9 40.75 1.39 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.593 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -176.6 132.84 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.835 0.35 . . . . 0.0 110.986 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.816 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 135.75 55.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.439 179.751 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.774 ' N ' HD13 ' A' ' 148' ' ' ILE . 20.7 p-10 -115.86 174.77 5.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.238 0.542 . . . . 0.0 112.07 -179.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.615 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.9 t80 -43.57 -32.07 0.87 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.727 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.32 -71.47 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.831 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.601 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.8 OUTLIER -55.06 -23.83 22.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.846 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.816 ' N ' HD11 ' A' ' 148' ' ' ILE . 1.9 t80 -57.75 -40.44 79.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.448 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.706 HD22 HD13 ' A' ' 97' ' ' LEU . 3.4 mt -58.99 -20.33 51.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.005 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 1.1 mm-40 -74.28 -26.66 60.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.93 0.395 . . . . 0.0 110.521 179.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -56.25 -63.13 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.034 179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.951 ' HE1' HD13 ' A' ' 100' ' ' LEU . 10.5 mtt -69.91 -32.41 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 -179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.411 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -47.73 -28.64 2.57 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.228 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.82 -21.91 73.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.637 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.854 HG22 ' HG3' ' B' ' 135' ' ' ARG . 24.0 t -53.96 -27.8 16.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.786 0.327 . . . . 0.0 111.279 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.885 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.832 0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -101.43 -79.39 0.51 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.586 ' O ' HD13 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -119.11 -33.8 4.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.074 -179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.644 ' H ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -117.12 170.89 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 120.983 0.421 . . . . 0.0 111.246 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.947 ' O ' HD12 ' B' ' 134' ' ' LEU . 3.5 p90 -166.43 105.01 0.63 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.287 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 7.2 t70 57.83 19.14 5.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.917 0.389 . . . . 0.0 110.616 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.947 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.1 mp -117.28 -39.22 3.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.971 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.854 ' HG3' HG22 ' A' ' 160' ' ' VAL . 11.8 ttt-85 -67.14 -35.59 80.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.097 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.07 14.15 40.27 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.077 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -128.71 -32.99 2.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.019 0.437 . . . . 0.0 110.293 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.46 ' CE1' ' CE ' ' A' ' 157' ' ' MET . 4.3 m-85 -45.76 -54.74 7.47 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.316 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -28.45 67.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.027 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.405 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER 63.42 135.32 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.921 -179.932 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.405 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 34.4 Cg_exo -57.92 -163.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.494 2.129 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 74.4 p -103.95 171.2 7.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.918 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -106.31 133.82 50.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 172.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 29.6 mtt-85 -155.1 95.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.884 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.9 149.38 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.482 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.5 mtt . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.836 0.35 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -93.1 89.97 6.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.871 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.64 104.51 0.22 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp -76.71 113.67 14.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.1 t -166.74 -47.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -76.78 -44.92 30.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.88 -30.23 68.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.926 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.66 -58.5 8.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.972 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.806 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -59.86 -33.63 72.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.958 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.8 t -51.23 -38.46 52.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -84.62 -20.8 30.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.122 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.681 HD13 ' CE1' ' B' ' 138' ' ' PHE . 74.6 mt -78.09 -44.55 25.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.146 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.428 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 17.4 t80 -61.56 -48.78 79.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.041 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -29.4 59.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.076 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.5 ttm -90.49 -28.88 18.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.947 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.453 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.37 -37.57 43.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.58 64.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -58.62 -30.2 67.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -70.84 -26.02 63.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.969 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.17 64.32 0.74 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.06 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -127.75 -48.75 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.849 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 138.08 -13.31 3.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.866 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.7 m-85 -135.36 165.81 24.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.681 0.241 . . . . 0.0 110.788 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.769 HG23 ' HB2' ' A' ' 116' ' ' GLU . 18.6 mt -116.26 137.36 50.26 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.228 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -131.21 -165.37 1.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.78 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.635 ' N ' HD13 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -55.45 -31.14 61.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.67 -62.51 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.769 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.9 mp0 -64.45 -30.08 71.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.766 HD11 ' SD ' ' A' ' 137' ' ' MET . 17.4 mt -54.58 -31.61 57.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.977 0.418 . . . . 0.0 110.785 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HA ' ' CD1' ' A' ' 133' ' ' ILE . 16.8 ttpt -57.54 -28.73 63.78 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 116' ' ' GLU . 13.5 mt -57.27 -26.75 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.884 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.21 -33.81 61.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.047 0.451 . . . . 0.0 110.256 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.528 HD13 ' CG2' ' A' ' 124' ' ' THR . 0.2 OUTLIER -60.85 -39.14 87.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.981 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.11 -26.98 2.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.1 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -72.76 -25.12 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.686 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.528 ' CG2' HD13 ' A' ' 121' ' ' LEU . 15.1 t -114.4 -48.6 2.87 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.775 0.321 . . . . 0.0 111.322 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.466 ' N ' HG23 ' A' ' 124' ' ' THR . . . 46.28 32.56 5.22 Favored Glycine 0 CA--C 1.518 0.228 0 C-N-CA 121.058 -0.592 . . . . 0.0 113.023 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.88 154.59 43.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.97 0.414 . . . . 0.0 111.472 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.539 HG22 ' N ' ' A' ' 128' ' ' ILE . 62.8 m 58.73 -99.47 0.1 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.279 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.583 HG21 ' HB2' ' A' ' 132' ' ' ASP . 0.5 OUTLIER -42.87 -83.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 120.646 0.26 . . . . 0.0 111.549 -179.829 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.44 ' HA ' HD11 ' A' ' 121' ' ' LEU . 11.0 p 55.41 28.48 11.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 173.11 -69.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.731 0.3 . . . . 0.0 111.205 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -50.16 -27.5 5.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.189 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.583 ' HB2' HG21 ' A' ' 128' ' ' ILE . 32.5 t70 -72.64 -26.13 61.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.413 ' CD1' ' HA ' ' A' ' 118' ' ' LYS . 24.8 mm -60.35 -48.7 87.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.836 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.08 -27.37 39.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.426 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.56 -33.25 36.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.382 -179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.672 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.2 tp -70.05 -42.57 72.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.907 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.766 ' SD ' HD11 ' A' ' 117' ' ' LEU . 13.2 tpt -45.09 -39.16 5.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.281 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -23.26 40.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.135 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -88.25 -48.76 7.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.149 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.417 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -57.13 -64.75 4.12 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.545 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.06 -50.62 14.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.733 0.302 . . . . 0.0 111.125 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt 43.02 29.95 0.22 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.115 0.483 . . . . 0.0 111.798 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -118.98 -6.99 10.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.423 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 67.49 24.64 8.67 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.669 0.271 . . . . 0.0 111.174 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.4 p30 -115.46 -20.94 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.54 58.16 3.65 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.594 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -178.17 112.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.812 0.339 . . . . 0.0 110.992 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.835 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 132.99 63.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.492 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.731 ' N ' HD13 ' A' ' 148' ' ' ILE . 27.2 p-10 -115.59 176.12 5.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.299 0.571 . . . . 0.0 112.13 -178.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.55 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.9 t80 -43.09 -31.15 0.52 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.849 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -68.07 -70.92 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.697 0.284 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.607 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.5 mt-10 -55.82 -23.39 30.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.813 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -58.22 -39.19 78.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.415 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.806 HD22 HD13 ' A' ' 97' ' ' LEU . 1.5 mt -60.5 -19.9 58.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.92 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 5.5 mm-40 -70.3 -24.76 63.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.964 0.411 . . . . 0.0 110.395 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.672 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -60.31 -61.29 2.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.53 179.508 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.749 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.4 ppp? -64.9 -24.1 67.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.38 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -45.75 -33.45 3.04 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.803 0.335 . . . . 0.0 111.128 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -70.42 -36.56 69.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.609 -0.805 . . . . 0.0 111.898 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.563 HG21 ' CB ' ' B' ' 138' ' ' PHE . 44.0 t -62.49 -24.66 35.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 111.077 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.908 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.3 p . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.94 119.71 39.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.911 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 24.4 mtmt 60.51 -178.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.977 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.759 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -56.77 154.61 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.025 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.531 ' CD2' HD13 ' B' ' 134' ' ' LEU . 0.2 OUTLIER -115.71 -109.18 0.36 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.534 -179.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.02 -8.14 54.4 Favored 'General case' 0 C--O 1.231 0.108 0 O-C-N 122.208 -0.308 . . . . 0.0 111.288 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.759 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.7 mp -66.68 -39.16 88.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.178 0.513 . . . . 0.0 110.48 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.515 ' HA ' HG22 ' A' ' 160' ' ' VAL . 37.3 ttt-85 -62.97 -55.49 25.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.137 -179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.57 64.79 0.82 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.671 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 3.6 ptmm? 176.13 -36.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.87 0.367 . . . . 0.0 110.628 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.681 ' CE1' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -56.25 -30.84 62.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.132 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.01 176.08 5.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.942 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.421 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -173.82 132.84 0.57 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.751 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 44.7 Cg_exo -56.77 143.26 91.03 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.463 2.108 . . . . 0.0 112.342 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.5 m -93.45 125.63 38.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.6 mt -141.74 179.78 6.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.958 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.86 83.46 1.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -156.98 -44.94 0.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.985 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -46.53 -29.41 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.6 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.983 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.864 0.364 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.54 147.36 39.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.903 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.78 157.07 7.19 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.52 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -70.29 135.4 48.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.847 0.356 . . . . 0.0 110.859 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 97' ' ' LEU . 47.2 t -176.6 -48.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -109.49 -34.49 6.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.856 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -59.67 -43.15 94.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.923 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -59.14 -55.81 30.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.751 HD11 ' HG2' ' A' ' 157' ' ' MET . 2.4 mt -66.0 -40.0 90.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.8 t -47.95 -38.44 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.077 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.54 -24.76 29.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.036 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -76.0 -41.63 50.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.181 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 149' ' ' ASP . 12.7 t80 -50.91 -61.5 2.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.781 0.324 . . . . 0.0 111.49 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -52.28 -49.95 63.11 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.421 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -56.72 15.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.107 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.402 ' CZ ' ' HE2' ' A' ' 120' ' ' MET . 0.5 OUTLIER -57.61 -30.36 65.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.76 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -59.34 -73.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.918 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm 63.82 10.3 5.08 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.558 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -111.15 -22.24 11.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.18 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.1 37.68 8.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.88 0.371 . . . . 0.0 110.999 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.0 p-10 -116.48 -40.85 3.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.411 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 112.6 13.49 11.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.851 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 110' ' ' GLY . 0.1 OUTLIER -154.51 165.07 37.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.699 0.25 . . . . 0.0 110.503 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.697 HG23 ' CB ' ' A' ' 116' ' ' GLU . 6.9 mt -116.78 138.83 46.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.907 0.384 . . . . 0.0 111.375 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.779 ' O ' HD23 ' A' ' 117' ' ' LEU . 3.9 t0 -126.99 -169.4 2.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.706 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.445 ' O ' HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.44 -25.73 62.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.134 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.69 -46.33 72.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.697 ' CB ' HG23 ' A' ' 112' ' ' ILE . 1.8 mt-10 -79.65 -28.98 40.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.871 ' CB ' HG23 ' A' ' 133' ' ' ILE . 3.6 mm? -56.14 -20.41 17.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.945 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.418 ' HA ' HD11 ' A' ' 133' ' ' ILE . 2.8 ttpp -72.75 -28.31 62.55 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.097 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 116' ' ' GLU . 7.6 mt -49.39 -52.83 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.609 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.456 ' HB2' HD21 ' B' ' 134' ' ' LEU . 1.4 ptp -56.48 -34.71 67.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.822 0.344 . . . . 0.0 110.862 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.749 HD13 HG13 ' A' ' 133' ' ' ILE . 2.0 mp -72.62 -29.39 63.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.697 179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -30.24 17.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.042 0.449 . . . . 0.0 110.452 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -71.55 -28.38 63.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.696 179.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.431 HG21 ' HD2' ' B' ' 132' ' ' PHE . 1.2 p -98.7 -66.92 0.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.979 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 59.58 28.56 65.34 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.479 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.537 ' O ' HG22 ' A' ' 127' ' ' THR . 1.0 OUTLIER -160.79 147.99 15.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.823 0.344 . . . . 0.0 111.126 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 127' ' ' THR . 0.5 OUTLIER 66.24 13.58 9.24 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.577 179.782 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.636 HD12 ' CD2' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -160.88 -86.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.017 179.701 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 10.3 p 54.73 105.21 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.883 0.373 . . . . 0.0 111.418 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.485 ' HA ' HD13 ' A' ' 133' ' ' ILE . 0.0 OUTLIER 71.23 -61.58 0.48 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.463 179.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -43.82 -34.57 1.63 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.702 ' HB3' HD21 ' A' ' 121' ' ' LEU . 34.7 t0 -73.38 -39.79 64.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.232 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.871 HG23 ' CB ' ' A' ' 117' ' ' LEU . 3.3 mp -61.93 -40.65 87.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 111.064 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.07 -41.76 88.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.401 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.01 -48.72 8.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.472 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.41 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 4.9 tp -53.5 -51.23 63.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.449 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -45.66 -29.8 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.363 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.79 -31.09 68.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.895 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.24 -52.07 31.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.834 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -58.19 -52.8 50.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.502 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -108.2 104.0 13.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.845 0.355 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.53 34.47 3.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -121.4 13.17 10.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.212 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 58.94 37.89 24.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.878 0.37 . . . . 0.0 111.034 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -115.48 -37.48 4.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.861 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.3 37.75 9.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.497 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -162.77 121.31 2.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.847 0.356 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.819 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.93 127.69 73.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.725 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.664 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.6 p-10 -152.27 130.63 12.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.648 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 46.68 -85.15 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.57 178.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 149' ' ' ASP . 0.5 OUTLIER -32.26 -64.8 0.16 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -179.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.653 ' C ' HD11 ' A' ' 148' ' ' ILE . 0.6 OUTLIER -77.97 -23.16 48.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.021 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.819 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.2 t80 -65.02 -48.82 72.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.846 0.355 . . . . 0.0 110.785 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.681 HD22 HD13 ' A' ' 97' ' ' LEU . 5.6 mt -58.21 -19.73 35.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.173 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.01 -13.81 60.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.983 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.42 ' HB2' ' O ' ' A' ' 153' ' ' PHE . 0.2 OUTLIER -71.42 -60.15 2.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.872 0.367 . . . . 0.0 110.691 179.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.751 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.5 ppp? -57.1 -24.67 55.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.142 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.63 -31.61 4.73 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.883 0.373 . . . . 0.0 110.929 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -67.66 -40.28 90.34 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.029 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' B' ' 135' ' ' ARG . 46.9 t -59.48 -25.74 32.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.776 0.322 . . . . 0.0 110.981 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.91 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.798 0.333 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -157.61 161.48 38.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 3.9 mmtm -94.16 150.37 20.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 57.57 165.79 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.498 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.7 OUTLIER -146.68 -117.69 0.07 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.04 -179.626 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.816 ' C ' HD12 ' B' ' 134' ' ' LEU . 23.2 t0 -72.03 47.54 0.15 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.058 0.456 . . . . 0.0 110.629 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.816 HD12 ' C ' ' B' ' 133' ' ' ASP . 6.9 mp -129.71 -42.08 1.3 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.985 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.892 ' HA ' HG22 ' A' ' 160' ' ' VAL . 1.8 ttt180 -56.97 -46.34 82.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.686 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -86.02 16.95 39.67 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.838 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -137.96 23.92 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.932 0.396 . . . . 0.0 110.204 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.769 ' CB ' HG21 ' A' ' 160' ' ' VAL . 0.3 OUTLIER -124.73 26.54 7.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.896 -179.645 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 5.7 mmtt -99.73 -61.22 1.4 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.964 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.459 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 7.8 tpt180 -155.54 131.78 5.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.039 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 14.8 Cg_exo -68.49 -167.14 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.49 2.127 . . . . 0.0 112.25 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 58.65 163.17 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.086 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 29.4 mt -113.42 -36.36 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.85 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.85 98.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.941 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 48.7 mtt85 58.98 32.33 22.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.416 ' CG1' ' N ' ' B' ' 147' ' ' ARG . 1.6 t 60.9 156.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.909 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.416 ' N ' ' CG1' ' B' ' 146' ' ' VAL . 10.2 ttm180 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.815 0.341 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 61.32 113.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.83 131.47 1.91 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.525 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.26 31.57 20.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -132.29 -44.56 0.93 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -55.77 -26.17 44.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.159 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -58.09 -32.61 68.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.46 -64.8 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.865 HD13 HD22 ' A' ' 154' ' ' LEU . 1.4 mt -63.07 -29.02 70.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.02 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 9.6 t -49.41 -44.09 44.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.88 0.372 . . . . 0.0 110.996 179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -84.61 -29.45 25.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.993 179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.683 HD12 ' HA ' ' A' ' 97' ' ' LEU . 18.6 mt -69.98 -21.33 63.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.434 ' CZ ' ' N ' ' A' ' 150' ' ' TYR . 18.8 t80 -78.71 -53.57 7.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 0.0 111.265 -179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.63 -19.05 57.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.449 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 9.6 mtm -71.53 -24.75 62.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.502 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.933 ' HA ' HD13 ' A' ' 119' ' ' ILE . 2.4 m-85 -97.0 -56.36 2.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.84 0.352 . . . . 0.0 111.168 -179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.13 -82.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.303 -179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.71 11.12 5.57 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.747 0.308 . . . . 0.0 111.219 -179.75 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -112.89 -1.26 14.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.326 -179.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.45 38.51 9.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.798 0.332 . . . . 0.0 111.096 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -116.44 -46.63 2.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.418 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 94.94 29.38 9.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.629 179.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.575 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 7.8 m-85 -140.47 138.26 34.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.528 0.204 . . . . 0.0 111.132 179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.804 HG23 ' HB3' ' A' ' 116' ' ' GLU . 4.5 mt -116.14 127.28 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.956 0.407 . . . . 0.0 110.951 179.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.629 ' O ' HD12 ' A' ' 117' ' ' LEU . 1.1 t0 -130.43 -166.74 1.72 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.851 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.426 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.4 mp -53.15 -30.31 36.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -69.48 -48.58 60.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.783 179.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.804 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.5 mp0 -76.61 -28.86 56.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.778 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.72 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.02 -30.6 66.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.873 0.368 . . . . 0.0 110.431 179.76 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -53.97 -26.92 28.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 109.816 178.762 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.933 HD13 ' HA ' ' A' ' 104' ' ' PHE . 22.2 mt -63.21 -26.35 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.483 179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.446 ' SD ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -66.56 -33.7 76.25 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.314 179.427 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.693 HD11 HD11 ' A' ' 133' ' ' ILE . 40.3 mt -59.09 -47.92 83.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -52.25 -26.74 12.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.0 0.429 . . . . 0.0 110.476 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.828 ' HB1' ' HB2' ' B' ' 133' ' ' ASP . . . -81.13 -22.03 39.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.22 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.883 HG22 ' CD1' ' B' ' 132' ' ' PHE . 11.9 p -87.48 -56.52 3.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.919 0.39 . . . . 0.0 110.477 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 90.55 -42.94 2.89 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.76 -0.734 . . . . 0.0 112.745 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -54.74 -176.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.848 0.356 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.479 ' O ' HD13 ' A' ' 128' ' ' ILE . 88.9 m -80.91 97.0 7.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.009 -179.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.479 HD13 ' O ' ' A' ' 127' ' ' THR . 30.5 mm -143.87 150.26 17.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.798 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -178.29 126.36 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.162 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 69.74 -61.54 0.44 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.577 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -44.0 -69.42 0.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.715 -179.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.434 ' OD1' HD12 ' A' ' 128' ' ' ILE . 2.2 m-20 -57.02 -33.71 67.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.29 -179.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.72 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.2 mt -67.73 -39.8 82.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.433 -179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -76.48 -30.29 57.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.113 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -86.14 -40.91 15.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.258 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.668 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 10.7 tp -65.28 -54.66 25.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.151 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -44.97 -35.29 2.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.489 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -55.55 -24.37 31.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.009 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -86.62 -49.36 7.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.031 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.41 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.09 -63.98 3.6 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.686 -179.858 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -77.67 -73.87 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.689 0.28 . . . . 0.0 111.037 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.01 28.04 10.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.152 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -116.55 3.97 13.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.406 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 60.84 23.99 13.97 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.657 0.265 . . . . 0.0 111.263 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -115.47 -22.74 9.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.162 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 74.39 55.17 5.73 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.584 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.47 116.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 0.0 110.938 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.765 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -118.02 130.13 73.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 179.89 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.728 ' N ' HD13 ' A' ' 148' ' ' ILE . 10.9 p-10 -115.39 177.79 4.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.338 0.589 . . . . 0.0 112.356 -178.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.643 ' CE1' HD21 ' A' ' 154' ' ' LEU . 4.2 t80 -40.99 -40.61 1.46 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.083 -179.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -70.46 0.17 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 0.0 110.75 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.702 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -59.21 -21.31 59.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.85 179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.765 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.4 t80 -60.9 -39.59 89.87 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.945 0.403 . . . . 0.0 110.453 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.865 HD22 HD13 ' A' ' 97' ' ' LEU . 2.3 mt -61.73 -18.23 58.91 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.643 179.488 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -69.07 -27.12 65.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.963 0.411 . . . . 0.0 110.211 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.668 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.1 OUTLIER -55.36 -63.85 1.03 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.173 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.808 ' SD ' HD11 ' A' ' 97' ' ' LEU . 2.7 ptp -58.26 -29.02 65.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.202 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.41 ' N ' ' HG3' ' A' ' 157' ' ' MET . 0.0 OUTLIER -51.6 -27.82 12.33 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.008 -179.925 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -69.46 -27.66 73.27 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.235 179.697 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' B' ' 135' ' ' ARG . 46.2 t -57.79 -29.31 34.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.83 0.348 . . . . 0.0 111.177 179.874 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.955 179.993 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -110.97 -29.7 7.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.972 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.18 135.86 36.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.825 HG23 ' HB2' ' B' ' 134' ' ' LEU . 4.0 mm -69.31 150.16 10.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.667 179.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.883 ' CD1' HG22 ' A' ' 124' ' ' THR . 0.3 OUTLIER -117.31 -108.28 0.37 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.744 -179.416 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.828 ' HB2' ' HB1' ' A' ' 123' ' ' ALA . 21.5 t70 -79.58 32.18 0.24 Allowed 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 121.03 0.443 . . . . 0.0 110.843 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.825 ' HB2' HG23 ' B' ' 131' ' ' ILE . 5.5 mp -109.97 -38.72 5.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.826 179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HB2' HG21 ' B' ' 131' ' ' ILE . 32.5 ttt180 -117.36 169.39 9.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.953 -179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 139' ' ' LYS . . . 111.51 -135.65 12.97 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.658 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.26 -27.93 0.28 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.658 0.266 . . . . 0.0 111.599 -179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.419 ' CZ ' ' O ' ' B' ' 133' ' ' ASP . 49.0 m-85 -44.31 -30.28 0.79 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.461 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 136' ' ' GLY . 0.0 OUTLIER -97.18 150.92 20.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.896 179.829 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.9 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -88.2 106.02 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.775 2.317 . . . . 0.0 112.502 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 32.2 p -68.18 -172.58 0.32 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.899 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 6.1 mp -130.05 178.58 6.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.835 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.85 103.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 60.67 81.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.33 -170.22 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.934 179.828 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.1 ptm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.865 0.364 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -123.92 147.2 47.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.92 110.58 3.57 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.498 -179.948 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 30.92 3.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.846 0.355 . . . . 0.0 110.822 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.44 -43.78 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.995 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.62 -33.86 68.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.915 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.57 -31.26 69.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.851 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -57.66 -60.41 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.889 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.913 HD13 ' HA ' ' A' ' 154' ' ' LEU . 10.0 mt -70.36 -28.7 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.762 179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 0.3 OUTLIER -46.51 -40.12 11.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.551 179.574 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -84.02 -28.44 27.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.198 179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.797 HD12 HD23 ' A' ' 97' ' ' LEU . 53.0 mt -63.27 -39.96 96.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.062 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.513 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 2.8 t80 -52.22 -54.3 32.78 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.84 0.352 . . . . 0.0 111.272 -179.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.73 -25.84 8.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -33.01 72.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.151 -179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.805 ' HA ' HD13 ' A' ' 119' ' ' ILE . 4.1 m-85 -94.27 -44.87 7.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.98 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -73.65 63.9 0.87 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 mmtp -75.8 -23.34 55.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.865 179.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -71.72 -17.37 62.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.055 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 66.23 76.12 0.32 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.876 0.37 . . . . 0.0 111.045 -179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -143.92 -46.37 0.27 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.22 3.62 6.73 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.03 179.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 0.5 OUTLIER -143.34 163.84 31.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.873 0.336 . . . . 0.0 110.659 -179.932 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.677 HG23 ' CB ' ' A' ' 116' ' ' GLU . 17.4 mt -116.26 131.05 69.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.101 0 CA-C-O 120.946 0.403 . . . . 0.0 111.1 179.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -118.14 -168.48 1.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.897 -179.818 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.417 HD21 ' CG ' ' A' ' 134' ' ' GLU . 8.5 mp -53.89 -44.57 70.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.087 -179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -58.04 -55.85 29.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.677 ' CB ' HG23 ' A' ' 112' ' ' ILE . 3.8 mp0 -67.78 -25.2 65.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -56.58 -33.74 66.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.834 179.826 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.437 ' HA ' HD12 ' A' ' 133' ' ' ILE . 19.7 ttpt -54.77 -30.43 56.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.499 179.603 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 104' ' ' PHE . 11.1 mt -62.15 -27.9 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.822 179.635 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.892 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -60.5 -49.93 75.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.501 179.652 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 132' ' ' ASP . 6.2 mp -64.87 -28.69 69.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.597 179.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -52.4 -29.83 26.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.343 179.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.664 ' HB3' ' CD1' ' B' ' 134' ' ' LEU . . . -69.21 -27.63 65.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.676 179.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.724 HG23 HD13 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -92.79 -56.04 3.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.927 179.988 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.91 27.06 11.55 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.413 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -104.02 -23.21 13.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.752 0.31 . . . . 0.0 111.169 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -62.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.247 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.649 HG22 HG22 ' A' ' 129' ' ' THR . 24.9 mm 70.8 -77.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.077 -179.816 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 128' ' ' ILE . 0.3 OUTLIER 164.85 172.13 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.184 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -23.73 28.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.815 0.34 . . . . 0.0 110.766 179.713 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -49.07 74.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.811 179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.61 ' HB3' HD21 ' A' ' 121' ' ' LEU . 3.3 t70 -53.88 -25.03 17.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.129 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 117' ' ' LEU . 28.9 mm -71.87 -46.94 58.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.214 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.417 ' CG ' HD21 ' A' ' 114' ' ' LEU . 9.6 mt-10 -76.88 -27.28 54.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.078 -179.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -43.03 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.139 -179.763 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.548 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.5 tp -69.44 -44.42 71.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.072 0.463 . . . . 0.0 110.387 179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.59 -33.04 1.64 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.2 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.53 -24.88 22.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -86.57 -50.48 6.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.978 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.447 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -52.36 -65.53 3.22 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.441 -179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -76.91 -76.26 0.18 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.706 0.289 . . . . 0.0 110.912 -179.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 56.63 27.46 12.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.048 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -113.45 2.18 15.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.385 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.56 25.16 14.99 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.677 0.275 . . . . 0.0 111.173 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.8 p30 -115.52 -25.14 8.02 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.113 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.34 48.55 5.02 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.602 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -177.29 129.11 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.901 0.382 . . . . 0.0 111.09 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.811 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.92 130.05 71.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.386 179.717 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.811 ' N ' HD13 ' A' ' 148' ' ' ILE . 25.1 p-10 -115.65 172.45 7.11 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.284 0.564 . . . . 0.0 112.203 -178.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.407 ' OH ' ' HA ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -36.03 -56.27 0.74 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.153 -179.957 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -47.0 -52.97 13.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.327 -179.686 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.616 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.8 mt-10 -76.88 -22.97 52.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.012 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.696 ' N ' HD11 ' A' ' 148' ' ' ILE . 8.6 t80 -62.51 -53.9 47.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.913 ' HA ' HD13 ' A' ' 97' ' ' LEU . 8.5 mt -58.2 -19.95 37.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.923 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.472 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 0.6 OUTLIER -71.41 -27.4 63.27 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.025 0.44 . . . . 0.0 110.241 178.875 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.548 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -53.1 -51.91 60.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.004 179.726 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.788 ' CG ' HD21 ' A' ' 97' ' ' LEU . 9.8 mmt -84.64 -35.41 22.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.207 -179.696 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -46.85 -29.49 2.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.196 -179.697 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -73.11 -25.01 74.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.277 179.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.94 HG22 ' HG3' ' B' ' 135' ' ' ARG . 47.2 t -51.22 -32.59 12.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.825 0.345 . . . . 0.0 111.269 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.869 -179.984 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.77 0.319 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -152.18 116.45 4.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.16 88.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.075 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.606 HG23 ' N ' ' B' ' 132' ' ' PHE . 0.0 OUTLIER 53.86 175.32 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.335 179.866 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.688 ' CD1' HD22 ' B' ' 134' ' ' LEU . 0.0 OUTLIER -143.91 -144.94 0.16 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.791 -179.876 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -46.01 -23.83 0.35 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 179.255 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.724 HD13 HG23 ' A' ' 124' ' ' THR . 0.3 OUTLIER -44.02 -40.61 4.9 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.632 179.29 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.94 ' HG3' HG22 ' A' ' 160' ' ' VAL . 2.8 ttt180 -63.06 178.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.69 179.782 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . 0.425 ' H ' HG13 ' A' ' 160' ' ' VAL . . . 66.66 136.27 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.275 179.785 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm 63.77 16.85 10.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.782 0.325 . . . . 0.0 110.9 -179.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 5.6 m-85 -118.36 21.99 12.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.686 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 160' ' ' VAL . 0.0 OUTLIER -150.9 155.94 40.19 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.673 179.887 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.42 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -178.94 132.88 0.28 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.745 179.967 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.42 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 98.5 Cg_endo -88.56 -21.38 1.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.827 2.351 . . . . 0.0 112.915 -179.534 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 69.38 -69.05 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.999 -179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.9 mt -138.94 177.76 7.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.959 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -167.79 113.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.854 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 43.44 67.16 0.68 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.465 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -47.21 -29.17 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.54 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.941 179.995 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 17.5 ttt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.876 0.37 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -130.12 88.67 2.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.45 85.14 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.492 179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.28 100.12 5.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 110.913 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.6 m -149.26 -53.72 0.17 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.55 -45.37 92.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.926 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.92 -27.54 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.005 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -58.06 -61.22 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.001 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.851 HD11 ' CG ' ' A' ' 157' ' ' MET . 15.0 mt -63.65 -23.51 67.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.118 179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.431 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 12.4 t -54.66 -41.08 69.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.89 0.376 . . . . 0.0 110.736 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -79.3 -29.83 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.558 179.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.659 HD12 HD23 ' A' ' 97' ' ' LEU . 38.0 mt -64.63 -39.35 93.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.775 179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.442 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 11.7 t80 -63.73 -46.56 84.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.066 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -55.59 -32.25 62.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.211 -179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 1.1 ttm -89.81 -48.34 7.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.158 -179.8 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.425 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -59.23 -27.18 65.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.209 -179.731 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -69.08 -72.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.939 -179.881 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.3 mttm 62.75 10.94 4.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.631 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.407 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 6.9 t30 -110.42 -21.85 11.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.158 -179.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 67.05 34.26 5.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.956 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 p-10 -116.45 -44.78 2.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.771 179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.415 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 116.5 7.49 13.81 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 0.0 113.027 179.808 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.521 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 5.5 m-85 -141.83 162.25 35.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.851 0.325 . . . . 0.0 110.921 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 116' ' ' GLU . 15.8 mt -116.36 129.65 72.44 Favored 'Isoleucine or valine' 0 C--O 1.231 0.094 0 CA-C-O 120.872 0.368 . . . . 0.0 111.15 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -126.13 -172.61 2.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.814 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.536 ' HA ' HD12 ' A' ' 117' ' ' LEU . 7.9 mp -47.25 -35.72 8.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.85 -53.65 50.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.994 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.75 ' HB2' HG23 ' A' ' 112' ' ' ILE . 6.4 mp0 -73.85 -27.81 61.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.985 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 133' ' ' ILE . 22.6 mt -54.33 -32.75 57.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.782 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.54 -37.17 65.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.33 179.506 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.425 ' HB ' ' CE1' ' A' ' 104' ' ' PHE . 16.8 mt -54.46 -33.4 26.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.92 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.7 ' HB3' HD21 ' B' ' 134' ' ' LEU . 2.2 mmt -59.32 -34.82 72.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.528 179.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.577 ' HB2' HD11 ' A' ' 133' ' ' ILE . 0.7 OUTLIER -87.15 -28.9 22.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.845 179.846 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -28.3 67.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.841 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.44 87.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.493 HG21 HG22 ' A' ' 127' ' ' THR . 10.1 t -91.99 -46.55 7.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.436 ' N ' HG23 ' A' ' 124' ' ' THR . . . 97.14 -29.98 9.82 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.515 -179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -177.63 129.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.934 -179.966 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 124' ' ' THR . 2.2 t -170.95 -49.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.998 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.619 HG21 ' CG ' ' A' ' 132' ' ' ASP . 40.8 mm -114.01 -87.56 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.097 179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.52 HG22 HG22 ' A' ' 128' ' ' ILE . 0.7 OUTLIER 165.84 175.04 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.751 0.31 . . . . 0.0 110.434 -179.956 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.25 -24.04 17.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.933 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.468 ' HB2' HG23 ' A' ' 129' ' ' THR . 0.2 OUTLIER -61.25 -51.08 70.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.999 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.619 ' CG ' HG21 ' A' ' 128' ' ' ILE . 0.2 OUTLIER -52.61 -27.34 16.58 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.248 -179.824 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.654 ' O ' HD13 ' A' ' 117' ' ' LEU . 26.2 mm -58.2 -51.79 66.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.943 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -75.24 -37.79 60.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.965 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.49 -31.61 71.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.843 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.53 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.8 tp -61.86 -46.41 89.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.611 179.861 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.623 ' HB2' HD11 ' A' ' 117' ' ' LEU . 12.8 tpt -41.08 -35.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.401 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.44 -30.35 12.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.39 -54.7 6.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.615 179.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.431 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -60.93 -56.94 21.31 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.038 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t0 -100.75 71.12 1.45 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.65 29.87 3.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.964 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -115.65 -10.49 11.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.291 179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 30.0 t30 64.33 54.11 1.61 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 110.827 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -115.46 -39.5 3.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.924 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 153.72 -47.36 0.54 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.567 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -145.46 -175.7 4.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.809 0.337 . . . . 0.0 111.013 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.87 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.98 137.06 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -179.949 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.87 ' N ' HD13 ' A' ' 148' ' ' ILE . 35.9 t70 -115.82 162.91 16.62 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.19 0.519 . . . . 0.0 112.094 -178.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.433 ' HB2' ' CD2' ' A' ' 101' ' ' PHE . 7.2 t80 -39.05 -33.46 0.12 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.883 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -65.0 -67.85 0.41 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.46 -22.43 61.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.88 179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.785 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.3 t80 -57.72 -41.04 80.98 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.924 0.393 . . . . 0.0 110.582 179.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.772 ' HA ' HD13 ' A' ' 97' ' ' LEU . 11.8 mt -60.89 -19.33 60.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.414 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 20.6 tt0 -69.92 -29.27 66.4 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.921 0.391 . . . . 0.0 110.582 179.34 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.53 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -52.13 -61.68 2.11 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.889 179.787 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.851 ' CG ' HD11 ' A' ' 97' ' ' LEU . 7.4 mmt -70.74 -37.51 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.949 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -48.75 -27.03 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.146 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -81.34 -18.65 68.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.892 -179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.862 HG13 ' HG2' ' B' ' 135' ' ' ARG . 19.3 t -54.33 -33.31 25.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.797 0.332 . . . . 0.0 111.231 -179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.888 179.962 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.788 0.328 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.14 -49.67 4.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.932 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.482 ' O ' ' O ' ' B' ' 131' ' ' ILE . 0.0 OUTLIER 61.42 -175.73 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.917 179.954 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.904 HD12 ' HB2' ' B' ' 135' ' ' ARG . 14.3 mm 54.01 141.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 179.225 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.732 ' O ' HD12 ' B' ' 134' ' ' LEU . 34.8 p90 177.85 112.2 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.968 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 2.3 t0 53.2 23.5 3.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.6 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.732 HD12 ' O ' ' B' ' 132' ' ' PHE . 1.0 OUTLIER -121.17 -42.13 2.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.272 -179.887 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.904 ' HB2' HD12 ' B' ' 131' ' ' ILE . 2.6 ttp180 -87.47 -55.54 3.75 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.044 -179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.95 135.99 48.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.471 -179.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 75.11 32.17 0.79 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.943 0.402 . . . . 0.0 110.774 -179.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' B' ' 134' ' ' LEU . 78.4 m-85 -140.34 36.4 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.591 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -113.38 -37.17 4.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.088 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.35 157.19 72.94 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.009 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.51 135.39 9.25 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.507 2.138 . . . . 0.0 112.434 -180.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 t -73.42 152.97 40.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.839 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 3.3 mt -60.05 156.38 15.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 17.3 mtt180 60.9 157.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.882 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.25 -38.24 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.957 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -49.19 162.02 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.501 -179.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.923 179.988 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.796 0.331 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -88.71 -34.84 17.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -114.15 57.54 0.46 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.507 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.9 161.59 21.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.793 0.33 . . . . 0.0 110.896 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.436 ' O ' HD12 ' A' ' 97' ' ' LEU . 0.3 OUTLIER -84.67 -30.92 24.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.906 -179.97 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -80.57 -34.21 35.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.899 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.63 -37.01 79.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.984 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.0 -39.25 85.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.901 -179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.74 HD21 ' HG2' ' A' ' 157' ' ' MET . 3.5 mt -80.59 -33.5 35.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.02 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.8 t -50.85 -39.91 54.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.17 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -84.51 -23.0 29.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.093 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.9 HD13 ' CE1' ' B' ' 138' ' ' PHE . 32.9 mt -74.68 -42.19 58.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.225 -179.827 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.447 ' CZ ' ' HA ' ' A' ' 149' ' ' ASP . 16.3 t80 -58.17 -49.4 77.16 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.794 0.33 . . . . 0.0 111.025 -179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.9 mtm-85 -59.07 -29.81 67.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.069 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -88.75 -26.86 21.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.067 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.676 ' CD2' HD13 ' A' ' 112' ' ' ILE . 1.1 t80 -79.89 -40.69 27.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.896 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.88 65.06 0.33 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -62.29 -27.97 69.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.002 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.81 -28.74 67.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.768 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 65.31 50.03 1.82 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.088 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -116.39 -36.06 4.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.914 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.45 -15.51 3.89 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.595 -0.812 . . . . 0.0 113.025 179.801 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.421 ' CD2' ' HG2' ' A' ' 147' ' ' ARG . 0.0 OUTLIER -148.42 -177.04 5.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.713 0.292 . . . . 0.0 110.78 -179.752 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.816 HG23 ' HB3' ' A' ' 116' ' ' GLU . 20.2 mt -116.04 133.27 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.847 0.356 . . . . 0.0 110.977 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.404 ' O ' HD23 ' A' ' 117' ' ' LEU . 7.3 m-20 -121.88 -166.13 1.35 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 -179.855 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.466 HD12 ' SD ' ' A' ' 137' ' ' MET . 2.6 mp -56.18 -42.28 76.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.956 -179.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -59.91 -58.24 9.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.753 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.816 ' HB3' HG23 ' A' ' 112' ' ' ILE . 5.0 mt-10 -62.02 -23.82 66.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.777 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.5 OUTLIER -59.08 -18.82 38.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.086 179.732 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -75.66 -25.61 56.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 0.0 110.805 179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.495 HD12 ' CA ' ' A' ' 116' ' ' GLU . 4.4 mt -49.8 -53.45 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.436 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.554 ' SD ' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.43 -38.54 69.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.789 0.328 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.928 HD12 HD11 ' A' ' 133' ' ' ILE . 2.3 mt -56.12 -31.8 63.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.599 179.723 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -23.05 54.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.03 0.443 . . . . 0.0 110.293 179.145 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.45 97.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.074 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.452 HG21 HG22 ' A' ' 127' ' ' THR . 12.1 t -90.47 -45.44 8.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.883 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.85 -33.25 5.31 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.768 179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.473 ' O ' ' HB ' ' A' ' 127' ' ' THR . 0.5 OUTLIER -179.25 127.01 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.835 0.35 . . . . 0.0 111.281 -179.898 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.909 HG23 HG12 ' A' ' 128' ' ' ILE . 9.9 t 176.22 -33.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.77 179.662 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.909 HG12 HG23 ' A' ' 127' ' ' THR . 0.7 OUTLIER -143.42 -86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.594 179.936 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.847 ' HA ' HD11 ' A' ' 121' ' ' LEU . 5.0 p 57.73 158.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.997 0.427 . . . . 0.0 111.523 179.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 52.64 25.35 3.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.437 179.771 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -156.67 -56.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.844 ' HB2' HD12 ' A' ' 128' ' ' ILE . 0.9 OUTLIER -69.18 -21.78 63.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.638 179.54 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.928 HD11 HD12 ' A' ' 121' ' ' LEU . 1.9 mt -65.63 -42.22 92.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.179 179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.08 -27.26 39.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.198 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -35.75 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.21 -179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.58 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 12.0 tp -63.28 -51.97 63.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.466 ' SD ' HD12 ' A' ' 114' ' ' LEU . 20.3 ttt -45.41 -29.85 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.437 -179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 39.6 tttt -55.84 -28.43 56.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.0 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -80.19 -47.72 14.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.899 179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -60.52 -54.03 40.51 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.406 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -101.73 105.55 16.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.62 33.06 5.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.956 -179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 56.5 m-20 -122.17 4.18 9.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 59.48 69.36 0.72 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.936 0.398 . . . . 0.0 110.83 179.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -155.55 -46.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 102.09 38.38 3.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.438 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.421 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 26.7 mtp180 -146.41 107.01 4.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.937 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.734 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.95 121.9 68.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.701 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.662 ' N ' HD13 ' A' ' 148' ' ' ILE . 34.9 p-10 -150.88 134.76 16.61 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.537 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.1 OUTLIER 40.55 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.725 178.952 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 149' ' ' ASP . 72.9 m-20 -35.86 -55.8 0.72 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.82 0.343 . . . . 0.0 111.871 -179.17 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.646 ' C ' HD11 ' A' ' 148' ' ' ILE . 16.8 mt-10 -83.57 -23.79 31.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.954 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.734 ' N ' HD11 ' A' ' 148' ' ' ILE . 3.2 t80 -64.83 -49.97 68.53 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.824 0.345 . . . . 0.0 110.802 179.784 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.537 HD22 HD13 ' A' ' 97' ' ' LEU . 4.7 mt -55.08 -23.24 19.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.805 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 0.2 OUTLIER -79.99 -16.57 54.9 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.493 178.975 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.58 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -66.09 -54.75 21.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.628 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 2.3 ppp? -58.72 -30.0 67.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.986 179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -49.19 -30.59 7.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.874 -179.961 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -64.92 -28.2 73.17 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.997 179.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.935 HG22 ' HA ' ' B' ' 135' ' ' ARG . 41.5 t -54.3 -31.14 21.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 179.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.805 0.336 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.47 69.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.896 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.41 102.9 0.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.657 HG23 HD13 ' B' ' 134' ' ' LEU . 1.7 mm -73.96 142.33 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.17 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.665 ' CE1' HD11 ' B' ' 134' ' ' LEU . 16.8 p90 -102.35 -140.94 0.35 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.965 179.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.426 ' O ' ' C ' ' B' ' 134' ' ' LEU . 1.6 t0 -28.97 -50.62 0.09 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.665 HD11 ' CE1' ' B' ' 132' ' ' PHE . 0.8 OUTLIER -29.21 -57.33 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.794 179.925 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.935 ' HA ' HG22 ' A' ' 160' ' ' VAL . 41.4 ttt180 -81.9 -51.79 7.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.353 -179.76 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -58.85 159.13 18.44 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.667 -179.609 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 5.8 mmtt 52.58 32.28 11.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.97 0.414 . . . . 0.0 110.686 -179.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 100' ' ' LEU . 32.8 m-85 -151.14 28.44 0.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.972 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.45 173.81 7.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.159 -179.74 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 141' ' ' PRO . 0.2 OUTLIER -155.91 114.62 2.18 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.603 179.917 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' B' ' 140' ' ' ARG . 3.6 Cg_exo -74.7 -71.32 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.81 2.34 . . . . 0.0 112.497 -179.533 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.613 HG22 ' O ' ' B' ' 142' ' ' THR . 47.4 m 55.66 26.7 9.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.893 0.378 . . . . 0.0 110.947 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 7.3 mt -148.38 152.08 36.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.757 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.73 124.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.023 179.982 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.597 ' C ' HG23 ' B' ' 146' ' ' VAL . 0.3 OUTLIER 58.66 -174.44 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.074 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.597 HG23 ' C ' ' B' ' 145' ' ' ARG . 0.2 OUTLIER 63.68 -71.6 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.198 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' B' ' 145' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.045 -179.71 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.849 0.357 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.3 tttm -84.14 105.8 15.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 92.45 65.32 1.11 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.452 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.52 148.85 48.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.794 0.331 . . . . 0.0 110.821 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.92 -61.22 0.5 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.066 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.493 ' CG ' HD13 ' A' ' 154' ' ' LEU . 9.2 tt0 -47.52 -29.14 2.58 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -64.52 -26.4 68.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.098 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -54.7 -60.3 3.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.156 -179.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.932 HD23 HD12 ' A' ' 100' ' ' LEU . 18.1 mt -63.92 -17.02 62.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.115 -179.989 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 150' ' ' TYR . 4.9 t -58.29 -40.59 82.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.944 0.402 . . . . 0.0 110.484 179.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.39 -31.96 42.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.461 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.932 HD12 HD23 ' A' ' 97' ' ' LEU . 15.6 mt -62.07 -45.53 93.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.849 179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.431 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 12.3 t80 -58.32 -46.12 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.05 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.19 -42.35 98.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.993 -179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -75.64 -29.4 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.086 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 1.9 t80 -78.61 -36.57 43.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.955 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -73.6 63.81 0.85 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.934 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -71.68 -23.79 61.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.05 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -69.7 -22.35 63.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.924 179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.9 78.83 0.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.084 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -148.47 -45.51 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 127.17 -20.8 5.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.618 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.448 ' CD1' ' HB3' ' A' ' 149' ' ' ASP . 2.7 m-85 -129.65 167.88 17.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.588 0.232 . . . . 0.0 110.699 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.649 HG23 ' CB ' ' A' ' 116' ' ' GLU . 11.7 mt -116.15 138.51 46.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-O 120.95 0.405 . . . . 0.0 111.2 179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.457 ' O ' HD13 ' A' ' 117' ' ' LEU . 20.6 p-10 -132.98 -173.66 3.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.947 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 114' ' ' LEU . 6.1 mp -52.71 -30.77 34.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.157 -179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -67.72 -46.07 73.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.816 179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.649 ' CB ' HG23 ' A' ' 112' ' ' ILE . 4.6 mt-10 -77.2 -28.68 53.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.812 ' HB3' HG23 ' A' ' 133' ' ' ILE . 4.9 mp -56.12 -22.49 28.59 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.827 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -66.93 -30.78 71.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.003 0.43 . . . . 0.0 110.276 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.2 mt -51.02 -63.37 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.952 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.44 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 4.6 ptp -54.01 -29.19 42.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.674 HD11 ' CG1' ' A' ' 128' ' ' ILE . 5.5 tt -68.02 -35.73 78.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.86 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.95 -28.63 69.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.674 179.77 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.44 -30.46 71.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.216 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.489 HG21 ' CE2' ' B' ' 132' ' ' PHE . 9.3 t -97.2 -42.11 7.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.112 -179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 55.65 22.1 31.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.744 -179.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.678 ' CG ' HD12 ' A' ' 128' ' ' ILE . 24.3 pt-20 -78.05 -159.4 0.16 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 122.839 -0.212 . . . . 0.0 110.601 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.2 m -89.69 96.6 10.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.118 0.485 . . . . 0.0 111.215 -179.669 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.678 HD12 ' CG ' ' A' ' 126' ' ' GLU . 0.2 OUTLIER -157.76 141.81 7.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.58 179.88 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 43.7 p -156.34 102.01 2.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 -179.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 70.16 -60.0 0.5 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.388 179.686 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -29.07 0.75 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.729 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -93.16 -33.94 13.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.335 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.812 HG23 ' HB3' ' A' ' 117' ' ' LEU . 2.5 mt -77.62 -35.31 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.471 -179.684 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.457 ' HG3' HD23 ' A' ' 114' ' ' LEU . 21.1 mt-10 -75.39 -31.2 60.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.215 -179.768 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.95 -34.2 20.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.183 -179.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.523 HD21 ' CD2' ' B' ' 134' ' ' LEU . 7.9 tp -64.1 -47.9 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.084 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.414 ' CA ' HD21 ' A' ' 117' ' ' LEU . 12.3 tpt -43.27 -31.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.636 -179.694 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -56.45 -29.78 62.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.862 179.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -74.95 -53.0 9.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.915 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.412 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -56.45 -68.23 1.81 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.484 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -81.82 96.54 7.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.812 0.339 . . . . 0.0 111.044 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -102.3 29.16 5.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.867 179.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -112.23 -13.96 13.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.209 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 68.13 39.34 2.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.912 0.387 . . . . 0.0 110.934 -179.923 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -115.51 -38.87 3.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.807 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 110.3 43.0 1.11 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.578 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -177.42 129.17 0.15 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.956 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.836 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -116.0 132.6 65.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.665 179.841 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 9.4 p-10 -115.66 175.16 5.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.295 0.569 . . . . 0.0 111.964 -179.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.736 ' CE1' HD21 ' A' ' 154' ' ' LEU . 10.0 t80 -40.66 -36.37 0.59 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.948 -179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -62.6 -69.4 0.26 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.655 0.264 . . . . 0.0 111.086 -179.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.651 ' C ' HD11 ' A' ' 148' ' ' ILE . 1.8 mt-10 -59.41 -22.26 61.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.94 179.9 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.906 ' CZ ' HD22 ' A' ' 97' ' ' LEU . 2.0 t80 -59.65 -40.86 89.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.614 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.736 HD21 ' CE1' ' A' ' 150' ' ' TYR . 9.6 mt -61.21 -18.49 58.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.145 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.458 ' HA ' ' HB2' ' A' ' 158' ' ' LYS . 27.0 mt-10 -72.29 -29.0 63.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.873 0.368 . . . . 0.0 110.731 179.417 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.663 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -54.48 -62.92 1.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.086 179.945 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.824 ' HG3' HD21 ' A' ' 97' ' ' LEU . 9.2 mmt -71.81 -32.29 67.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.026 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 155' ' ' GLU . 0.1 OUTLIER -46.5 -28.69 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.206 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -78.61 -22.5 66.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.765 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 157' ' ' MET . 19.6 t -52.07 -32.79 15.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.321 179.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.965 179.996 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.825 0.345 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 60.54 160.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -34.35 8.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.917 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.6 HD12 ' HB2' ' B' ' 135' ' ' ARG . 6.3 mm -102.61 134.47 43.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.386 -179.734 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.2 OUTLIER -151.18 -93.02 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.919 179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . 0.422 ' C ' HD12 ' B' ' 134' ' ' LEU . 8.2 t0 -91.31 23.55 3.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.084 0.469 . . . . 0.0 109.943 178.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.663 HD23 ' HE2' ' A' ' 156' ' ' PHE . 5.1 mp -105.76 -43.17 4.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.231 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.65 ' HG3' HG13 ' A' ' 160' ' ' VAL . 46.5 ttp180 -84.21 -58.62 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.107 -179.785 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -60.81 135.27 49.29 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 9.7 mmtm 76.97 29.58 0.59 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.89 0.376 . . . . 0.0 110.938 -179.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' B' ' 134' ' ' LEU . 56.1 m-85 -137.04 31.15 2.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.567 179.726 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -100.26 -167.66 1.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.875 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.81 157.68 41.1 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.852 179.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.6 105.84 2.1 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 122.259 1.973 . . . . 0.0 112.438 -179.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 57.9 p -76.04 -50.94 13.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 16.2 mt -147.6 -70.26 0.23 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 12.3 tpp180 61.23 85.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.862 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -91.09 -43.66 9.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.892 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.99 -169.05 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.87 -179.934 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.893 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.6 ttt . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.83 0.348 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.36 81.7 0.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.88 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 88.62 109.6 1.1 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.51 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -51.04 43.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.793 0.33 . . . . 0.0 110.867 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.01 38.72 13.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.943 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -177.98 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.88 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -65.71 -37.04 85.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.892 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.36 -57.47 12.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 154' ' ' LEU . 3.2 mt -56.67 -26.85 57.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.094 179.834 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 150' ' ' TYR . 6.3 t -53.27 -57.03 11.95 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.903 0.382 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -80.63 -24.78 38.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.437 179.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.492 ' HA ' HD12 ' A' ' 100' ' ' LEU . 7.6 tp -59.19 -36.79 75.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.927 179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.408 ' HB2' ' CD2' ' A' ' 153' ' ' PHE . 52.7 t80 -73.67 -40.73 63.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.915 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.2 mtt180 -59.3 -30.53 68.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.056 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.0 mtm -88.51 -30.6 19.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.99 -179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.455 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.7 OUTLIER -75.75 -30.63 59.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.923 -179.963 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -93.07 65.29 3.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.904 -179.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.796 ' HD3' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -60.74 -31.44 70.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.898 179.979 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -68.08 -26.32 65.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.785 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.48 63.31 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.203 179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -116.44 -36.21 4.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 121.08 -19.99 8.63 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.688 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.447 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 6.8 m-85 -136.54 169.87 16.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.583 0.23 . . . . 0.0 110.853 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.844 HG23 ' HB3' ' A' ' 116' ' ' GLU . 16.6 mt -116.19 132.77 64.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.927 0.394 . . . . 0.0 111.097 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.22 -166.77 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.786 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 134' ' ' GLU . 2.0 mm? -55.86 -31.32 62.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.072 -179.999 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -65.93 -50.9 62.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.903 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.844 ' HB3' HG23 ' A' ' 112' ' ' ILE . 1.3 mt-10 -75.72 -30.08 59.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.74 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.686 HD13 ' HG3' ' A' ' 120' ' ' MET . 0.3 OUTLIER -54.06 -25.65 22.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.762 179.689 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 133' ' ' ILE . 19.2 ttpt -63.19 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.195 179.259 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.796 HD11 ' HD3' ' A' ' 106' ' ' LYS . 9.2 mt -55.61 -29.91 25.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.881 179.639 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.686 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -66.01 -39.46 90.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.085 0.469 . . . . 0.0 110.171 179.544 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.529 HD22 HD11 ' A' ' 133' ' ' ILE . 18.8 tp -67.31 -38.22 84.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.986 179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -23.99 33.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.942 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.74 79.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.211 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 121' ' ' LEU . 14.8 t -95.7 -41.6 8.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.14 -179.725 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 95.75 -34.19 5.05 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 88.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.861 0.362 . . . . 0.0 110.802 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -54.36 101.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.154 -179.929 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.771 HD12 ' HB3' ' A' ' 132' ' ' ASP . 0.4 OUTLIER -66.56 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.694 179.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.49 ' O ' ' N ' ' A' ' 131' ' ' ASP . 7.1 t -178.33 34.48 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 111.884 0.328 . . . . 0.0 111.884 179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 61.8 -71.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.762 0.315 . . . . 0.0 110.929 179.593 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 129' ' ' THR . 4.1 m-20 -47.97 -33.94 8.5 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.614 179.675 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.771 ' HB3' HD12 ' A' ' 128' ' ' ILE . 11.2 t0 -62.97 -41.31 99.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.014 179.298 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.765 HG12 HD11 ' A' ' 128' ' ' ILE . 2.6 mt -56.12 -38.75 55.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.729 179.308 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.454 ' HG3' HD11 ' A' ' 114' ' ' LEU . 2.1 tt0 -53.84 -38.93 65.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -55.96 -34.41 65.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.888 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 8.5 tp -70.93 -47.76 57.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.677 179.816 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.444 ' HG3' HD23 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.31 -32.71 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.389 179.967 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 42.3 tttm -54.9 -24.4 23.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.011 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -81.98 -48.25 11.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.439 ' C ' HG13 ' A' ' 148' ' ' ILE . . . -49.05 -63.39 3.97 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.661 -179.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -77.22 -73.18 0.31 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.715 0.293 . . . . 0.0 110.855 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 13.2 tttm 51.17 27.52 3.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.287 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.8 m-20 -116.99 5.76 12.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.398 -179.921 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 1.6 t30 59.19 35.7 23.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.846 0.355 . . . . 0.0 110.981 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -115.46 -38.31 3.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 99.49 27.18 8.2 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.405 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.407 ' HG2' ' CD2' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -170.06 137.46 1.58 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.882 0.372 . . . . 0.0 110.911 179.985 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.87 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.9 131.11 69.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.676 179.941 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.778 ' N ' HD13 ' A' ' 148' ' ' ILE . 46.7 t0 -115.65 163.27 16.04 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.024 0.44 . . . . 0.0 111.947 -179.002 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.668 ' CE1' HD21 ' A' ' 154' ' ' LEU . 8.1 t80 -31.68 -38.9 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.368 -179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.84 -63.29 1.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.743 0.306 . . . . 0.0 110.777 179.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.514 ' C ' HD11 ' A' ' 148' ' ' ILE . 5.9 mt-10 -62.08 -26.57 68.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.773 179.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.87 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.3 t80 -55.69 -39.61 71.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.645 179.799 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.727 HD22 HD13 ' A' ' 97' ' ' LEU . 3.9 mt -61.97 -19.02 62.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.917 179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.18 -20.18 60.29 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.951 0.405 . . . . 0.0 110.653 179.235 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -65.2 -56.98 9.76 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.607 179.709 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.599 ' HG2' HD21 ' A' ' 97' ' ' LEU . 0.0 OUTLIER -62.5 -25.45 68.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.268 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -34.81 7.63 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.129 -179.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -65.57 -36.88 93.03 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.187 179.719 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.527 HG22 ' HA ' ' B' ' 135' ' ' ARG . 21.5 t -61.96 -24.33 34.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.784 0.326 . . . . 0.0 111.197 179.874 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.93 179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.771 0.319 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.34 117.25 22.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.889 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -32.52 7.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.711 HD12 ' HB2' ' B' ' 135' ' ' ARG . 16.8 mm -94.52 134.01 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.0 179.926 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.763 ' H ' HD12 ' B' ' 134' ' ' LEU . 43.9 p90 -179.01 115.56 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.881 179.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 t70 62.52 18.32 10.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.869 -179.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.763 HD12 ' H ' ' B' ' 132' ' ' PHE . 0.4 OUTLIER -125.67 -58.92 1.39 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.438 179.824 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.711 ' HB2' HD12 ' B' ' 131' ' ' ILE . 60.7 ttp85 -51.54 -39.89 58.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.4 14.87 48.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.831 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -137.12 14.81 3.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.815 0.341 . . . . 0.0 110.615 179.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.468 ' HB2' HG21 ' A' ' 160' ' ' VAL . 1.9 m-85 -107.67 29.2 7.43 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.816 -179.785 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -104.37 -167.47 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.448 ' HG3' ' HD2' ' B' ' 141' ' ' PRO . 13.1 tpt180 -108.25 140.83 22.1 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.845 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.448 ' HD2' ' HG3' ' B' ' 140' ' ' ARG . 46.6 Cg_exo -57.01 -16.5 21.02 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.626 2.217 . . . . 0.0 113.088 -179.6 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 3.1 p -46.52 98.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.854 0.359 . . . . 0.0 111.375 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 143' ' ' LEU . 11.6 mt 60.85 156.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.952 179.912 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.57 -45.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 179.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -90.6 115.0 27.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.4 t -76.46 149.65 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.927 179.729 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 tmm? . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.818 0.342 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -137.37 101.13 4.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -156.65 145.33 11.95 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -145.23 145.71 31.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.791 0.329 . . . . 0.0 110.935 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -79.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.32 -59.3 2.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.944 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -58.67 -27.05 64.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.5 -48.0 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.964 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.835 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 0.6 OUTLIER -67.01 -30.32 70.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.872 179.952 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.18 -35.79 49.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -83.69 -28.36 28.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.936 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mt -71.37 -42.38 68.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.045 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 19.1 t80 -58.14 -42.42 85.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.081 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -53.99 50.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.223 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 8.6 mtp -66.3 -31.39 72.16 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.163 -179.727 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.45 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.2 OUTLIER -78.24 -29.51 48.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.968 -179.936 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -91.99 65.18 4.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.061 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.77 ' CD ' HD11 ' A' ' 119' ' ' ILE . 0.0 OUTLIER -57.91 -30.83 66.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.905 179.815 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -67.52 -28.37 67.77 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.757 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 62.76 56.97 1.83 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.099 -179.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 p-10 -116.43 -45.0 2.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.855 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 133.81 -16.51 4.5 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.71 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 1.6 m-85 -134.49 164.82 26.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.693 0.247 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.693 HG23 ' HB2' ' A' ' 116' ' ' GLU . 13.7 mt -116.42 140.39 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-O 120.883 0.373 . . . . 0.0 111.156 179.809 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -131.64 -167.18 1.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.796 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.517 HD21 ' HG3' ' A' ' 134' ' ' GLU . 0.9 OUTLIER -55.47 -30.0 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.983 179.973 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.38 -62.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.756 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.693 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.2 mt-10 -66.03 -30.55 71.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.738 179.811 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.696 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -52.66 -31.51 37.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.617 179.734 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.534 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -54.73 -35.89 64.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.968 179.275 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.77 HD11 ' CD ' ' A' ' 106' ' ' LYS . 15.8 mt -49.33 -32.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.969 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.432 ' CE ' ' CZ ' ' A' ' 104' ' ' PHE . 2.8 mmt -70.33 -32.28 69.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.324 179.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.935 HD13 HG23 ' A' ' 124' ' ' THR . 0.2 OUTLIER -65.24 -28.81 69.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.817 179.732 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -23.98 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.579 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.53 -24.88 31.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.533 -179.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.935 HG23 HD13 ' A' ' 121' ' ' LEU . 0.5 OUTLIER -106.07 -60.58 1.62 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.458 -179.676 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.623 ' H ' HD13 ' A' ' 121' ' ' LEU . . . 51.18 32.33 28.45 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.839 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.63 ' O ' HG22 ' A' ' 127' ' ' THR . 7.3 tt0 -175.75 165.49 3.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 111.224 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.753 ' O ' HG23 ' A' ' 128' ' ' ILE . 9.6 t 51.11 29.72 4.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.924 179.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.753 HG23 ' O ' ' A' ' 127' ' ' THR . 0.7 OUTLIER 178.53 -86.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.014 178.925 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 4.4 p 58.92 111.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.862 0.363 . . . . 0.0 111.102 179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 72.53 -60.82 0.52 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.373 179.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.16 -46.67 17.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.793 0.33 . . . . 0.0 111.419 -179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.57 -23.66 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.08 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.696 HG23 ' HB3' ' A' ' 117' ' ' LEU . 25.4 mm -64.18 -50.49 76.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.517 ' HG3' HD21 ' A' ' 114' ' ' LEU . 2.3 tt0 -68.63 -25.09 64.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.357 -179.715 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -85.2 -47.76 9.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.268 -179.671 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.445 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 6.8 tp -59.73 -46.06 90.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.913 0.387 . . . . 0.0 111.081 -179.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.453 ' HA ' HD11 ' A' ' 117' ' ' LEU . 1.2 tmt? -44.23 -32.55 1.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.458 -179.852 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -30.92 68.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.906 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -75.46 -47.71 25.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.987 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -55.86 -62.4 6.37 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -90.57 107.52 19.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 mtmt -126.58 32.87 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.0 m-20 -114.33 5.7 15.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 60.22 38.01 20.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.96 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -115.46 -39.68 3.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 109.42 20.86 7.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.765 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -161.43 146.02 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.913 0.387 . . . . 0.0 111.075 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.81 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -115.94 133.18 63.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.532 179.892 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.74 ' N ' HD13 ' A' ' 148' ' ' ILE . 17.1 p-10 -115.67 176.74 4.94 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.294 0.568 . . . . 0.0 112.059 -178.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.923 ' CE1' HD21 ' A' ' 154' ' ' LEU . 2.5 t80 -43.03 -36.18 1.5 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.86 -179.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -63.1 -71.59 0.16 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.841 -179.947 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.596 ' C ' HD11 ' A' ' 148' ' ' ILE . 21.7 mt-10 -55.26 -24.2 26.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.904 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.835 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.2 t80 -59.23 -40.94 87.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.651 179.755 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.923 HD21 ' CE1' ' A' ' 150' ' ' TYR . 8.4 mt -62.81 -17.09 60.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.22 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -70.67 -25.72 63.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.892 0.377 . . . . 0.0 110.372 179.119 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.445 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -56.52 -59.66 4.66 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.932 179.787 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.659 ' HG3' HD21 ' A' ' 97' ' ' LEU . 1.0 OUTLIER -65.03 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.605 -179.907 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -44.87 -30.2 0.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.312 -179.822 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -80.89 -27.39 50.43 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.481 179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 38.4 t -61.61 -27.12 41.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.319 . . . . 0.0 111.117 179.921 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.962 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.78 0.324 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -134.22 -75.04 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -49.55 2.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.69 HD13 ' HD3' ' B' ' 135' ' ' ARG . 0.0 OUTLIER -130.12 166.85 26.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.122 179.85 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.506 ' CD1' ' N ' ' B' ' 132' ' ' PHE . 0.1 OUTLIER -145.64 -94.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.408 -179.673 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.2 48.59 1.64 Allowed 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.189 0.519 . . . . 0.0 110.386 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.446 ' HB2' ' CG2' ' B' ' 131' ' ' ILE . 1.2 mp -147.52 -54.72 0.22 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.127 -179.635 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 40.8 ttp180 -57.36 -40.43 78.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.865 179.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.36 14.88 37.61 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.447 -0.883 . . . . 0.0 112.83 -179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 20.6 mmtt -130.64 -32.91 1.66 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.872 0.367 . . . . 0.0 110.55 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -49.83 -27.24 4.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.224 179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 7.6 mttt -54.77 -177.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.059 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -96.04 139.74 21.94 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.036 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.53 -167.49 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.449 2.1 . . . . 0.0 112.2 179.993 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 1.3 m -162.01 113.19 1.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.882 179.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 4.0 mt -113.56 -60.82 1.83 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.86 -179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -146.6 152.97 39.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.24 88.1 3.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.893 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -48.21 141.26 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.521 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.884 179.993 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 11.7 mtm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.05 -47.0 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.912 180.0 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -59.77 -179.28 1.75 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.518 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -121.86 164.82 16.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.832 0.349 . . . . 0.0 110.878 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.0 t -176.99 -60.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -104.38 -29.12 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -60.35 -31.12 70.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.889 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.27 -64.85 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 154' ' ' LEU . 1.5 mt -66.84 -27.43 67.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.025 -179.963 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.8 t -54.9 -41.89 71.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -84.51 -28.71 26.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.089 -179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.615 HD13 ' CE2' ' B' ' 138' ' ' PHE . 33.1 mt -66.44 -45.0 81.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.13 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 153' ' ' PHE . 30.4 t80 -59.64 -39.08 83.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 -179.868 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -50.39 73.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 50.0 ttp -68.73 -29.4 67.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.165 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.448 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.4 OUTLIER -79.5 -44.77 20.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.883 -179.963 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -70.67 65.89 0.33 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -27.49 64.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -69.57 -29.72 67.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 63.84 51.48 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.934 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -116.37 -45.72 2.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.977 -179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 139.32 -17.76 3.11 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.871 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 8.3 m-85 -134.39 169.51 17.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.697 0.284 . . . . 0.0 110.843 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.791 HG23 ' HB3' ' A' ' 116' ' ' GLU . 19.5 mt -116.27 132.67 65.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.902 0.382 . . . . 0.0 110.949 179.662 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 -127.36 -169.35 2.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.88 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -51.32 -31.2 20.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.098 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -63.1 -61.91 2.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.744 179.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.791 ' HB3' HG23 ' A' ' 112' ' ' ILE . 2.5 mt-10 -66.39 -27.78 68.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.819 179.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.81 HD12 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -53.21 -29.99 35.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.737 179.76 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.49 -37.44 75.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.421 179.494 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.5 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.6 mt -50.68 -30.59 8.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.258 179.771 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.551 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.4 OUTLIER -69.96 -32.62 70.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.526 179.791 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.75 HD21 HG12 ' A' ' 128' ' ' ILE . 0.1 OUTLIER -69.61 -28.34 65.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.106 -179.932 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -52.55 -30.03 28.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.919 0.39 . . . . 0.0 110.779 179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -14.7 56.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.382 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.766 ' O ' HD11 ' A' ' 128' ' ' ILE . 21.4 p -122.18 71.4 1.0 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.932 0.396 . . . . 0.0 110.568 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -68.56 65.74 0.42 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.657 ' O ' HD13 ' A' ' 128' ' ' ILE . 12.6 pt-20 -150.28 -161.39 1.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.595 0.236 . . . . 0.0 110.703 179.865 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.432 ' O ' HG23 ' A' ' 128' ' ' ILE . 0.4 OUTLIER -83.05 96.66 8.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.861 0.362 . . . . 0.0 111.337 -179.698 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.766 HD11 ' O ' ' A' ' 124' ' ' THR . 0.2 OUTLIER -158.03 -27.57 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.676 179.685 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.713 HG22 ' HG ' ' A' ' 121' ' ' LEU . 69.3 p -38.68 152.64 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.865 0.364 . . . . 0.0 111.975 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 65.23 -73.86 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.31 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.4 -66.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.383 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -58.6 -45.12 89.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.81 HG23 HD12 ' A' ' 117' ' ' LEU . 2.5 mt -57.42 -46.65 85.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.364 -179.879 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -64.2 -25.79 68.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.216 -179.912 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -84.47 -43.03 14.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.185 -179.733 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.54 HD21 ' HZ ' ' A' ' 156' ' ' PHE . 9.4 tp -64.35 -46.46 83.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.6 -31.78 2.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.349 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -64.05 -29.94 71.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.885 179.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.03 -47.58 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.966 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -51.79 -62.01 5.96 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.505 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -81.65 88.37 6.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.857 0.36 . . . . 0.0 110.839 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.56 30.1 3.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.902 -179.952 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -112.5 -13.2 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 67.75 36.5 3.55 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.853 0.359 . . . . 0.0 110.904 -179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -115.47 -39.13 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.798 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.39 30.13 2.32 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.621 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . 0.433 ' HB3' ' CD2' ' A' ' 111' ' ' TYR . 2.2 mtt180 -168.4 141.8 3.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.906 0.384 . . . . 0.0 111.034 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.848 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.1 OUTLIER -124.64 126.51 71.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.566 179.879 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.644 ' N ' HD13 ' A' ' 148' ' ' ILE . 7.7 p-10 -115.58 -179.87 3.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.334 0.588 . . . . 0.0 112.146 -179.053 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.691 ' CE1' HD21 ' A' ' 154' ' ' LEU . 7.9 t80 -38.96 -33.01 0.1 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.162 -179.74 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.35 -78.48 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.723 0.297 . . . . 0.0 110.972 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.55 ' C ' HD11 ' A' ' 148' ' ' ILE . 3.1 mt-10 -52.91 -25.32 11.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.001 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.848 ' N ' HD11 ' A' ' 148' ' ' ILE . 2.1 t80 -56.5 -39.64 73.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.38 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 97' ' ' LEU . 4.3 mt -60.74 -20.07 60.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.998 179.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.9 -18.56 61.4 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.571 179.204 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.592 ' HE2' HD23 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -66.56 -56.0 12.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.92 179.837 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.773 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 ppp? -63.62 -23.21 67.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.36 -179.678 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -29.8 2.17 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.848 0.356 . . . . 0.0 110.996 -179.927 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -72.35 -42.92 47.93 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.032 179.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.759 HG22 ' HG3' ' B' ' 135' ' ' ARG . 48.5 t -59.78 -25.0 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.877 0.37 . . . . 0.0 110.984 179.572 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.905 179.98 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.87 0.367 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -91.21 155.95 18.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm -93.34 131.65 38.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.598 HD13 ' HB2' ' B' ' 135' ' ' ARG . 0.0 OUTLIER 59.14 162.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.045 179.967 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.6 ' CE2' HG21 ' A' ' 124' ' ' THR . 0.5 OUTLIER -144.84 -123.0 0.08 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.961 -179.875 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -59.84 -18.19 42.14 Favored 'General case' 0 CA--C 1.528 0.107 0 O-C-N 122.166 -0.333 . . . . 0.0 111.182 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 156' ' ' PHE . 6.0 mp -59.67 -40.63 88.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.925 0.393 . . . . 0.0 110.901 -179.954 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.759 ' HG3' HG22 ' A' ' 160' ' ' VAL . 3.7 ttp-105 -63.12 -53.48 52.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.005 -179.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -70.28 65.39 0.75 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.761 -179.718 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 4.9 ptmm? 175.45 -35.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.878 0.371 . . . . 0.0 110.688 179.851 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.615 ' CE2' HD13 ' A' ' 100' ' ' LEU . 0.2 OUTLIER -56.87 -29.98 63.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.055 179.984 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.37 130.37 55.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.946 -179.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.406 ' HB2' ' CD ' ' B' ' 141' ' ' PRO . 0.0 OUTLIER -77.57 171.65 11.89 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.937 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.406 ' CD ' ' HB2' ' B' ' 140' ' ' ARG . 25.1 Cg_exo -62.6 164.51 18.1 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.376 2.051 . . . . 0.0 112.269 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 82.5 p -148.4 -48.29 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.492 HD13 HG21 ' B' ' 146' ' ' VAL . 0.4 OUTLIER -84.37 -174.39 5.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.914 -179.923 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -118.62 -52.77 2.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.883 179.982 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 ptt-85 -133.79 108.95 8.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.953 179.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.492 HG21 HD13 ' B' ' 143' ' ' LEU . 0.2 OUTLIER -122.47 -45.25 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.982 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 13.0 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.975 -179.863 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.802 0.335 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.74 178.41 2.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.57 -78.19 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.983 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt 60.67 77.77 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.877 0.37 . . . . 0.0 110.899 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.59 -43.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.885 179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -21.0 59.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.167 179.942 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.79 -31.88 63.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.944 179.984 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -60.56 -64.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.774 179.872 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.786 ' HA ' HD12 ' A' ' 100' ' ' LEU . 3.5 mt -67.07 -27.3 67.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.798 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.442 ' HA ' ' OH ' ' A' ' 150' ' ' TYR . 33.9 t -51.33 -46.35 62.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.68 -21.77 30.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.164 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.786 HD12 ' HA ' ' A' ' 97' ' ' LEU . 33.6 mt -71.41 -49.96 36.67 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.375 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.482 ' CD2' ' CE2' ' A' ' 150' ' ' TYR . 13.7 t80 -55.75 -46.77 77.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.789 0.328 . . . . 0.0 111.065 -179.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 26.6 mtt180 -60.8 -29.83 69.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.064 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -19.48 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.254 -179.823 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.443 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -92.7 -30.2 15.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.087 -179.806 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -73.17 -75.43 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 9.29 5.61 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.608 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -107.28 -18.96 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.688 0.28 . . . . 0.0 111.198 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.02 39.89 7.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.956 -179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 31.9 p-10 -116.45 -41.95 3.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' CD1' ' A' ' 111' ' ' TYR . . . 114.28 -2.46 23.79 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.023 179.895 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 3.6 m-85 -139.07 164.1 30.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.82 0.31 . . . . 0.0 110.751 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 116' ' ' GLU . 9.9 mt -116.26 142.27 30.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.959 0.409 . . . . 0.0 111.268 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.54 -175.48 3.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.588 ' H ' HD22 ' A' ' 114' ' ' LEU . 0.2 OUTLIER -49.66 -30.33 8.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.087 -179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -62.62 -65.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.819 179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.1 mt-10 -63.93 -29.74 70.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.72 -26.19 13.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.711 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 133' ' ' ILE . 28.0 ttpt -64.13 -31.25 72.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 179.56 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.541 HD12 ' O ' ' A' ' 116' ' ' GLU . 10.5 mt -52.16 -26.36 8.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.805 179.6 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.408 ' HB3' HD21 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -76.05 -41.45 50.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.26 179.464 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 128' ' ' ILE . 3.4 tt -72.94 -34.3 66.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.703 179.777 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -48.11 -28.38 2.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.088 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.2 -39.37 82.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.072 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.488 HG23 ' N ' ' A' ' 125' ' ' GLY . 13.7 t -96.45 -49.99 4.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.169 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.488 ' N ' HG23 ' A' ' 124' ' ' THR . . . 49.82 32.61 18.48 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.87 179.9 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -149.81 161.03 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.003 0.43 . . . . 0.0 111.327 -179.88 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.487 HG22 ' N ' ' A' ' 128' ' ' ILE . 67.2 m 64.53 -97.02 0.05 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.354 179.674 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.521 HD13 ' CB ' ' A' ' 132' ' ' ASP . 0.2 OUTLIER -44.59 -80.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.61 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 3.4 p 61.19 114.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 133' ' ' ILE . 1.7 mt-10 69.91 -62.02 0.43 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.486 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -45.19 -54.9 6.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.69 -179.584 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.521 ' CB ' HD13 ' A' ' 128' ' ' ILE . 7.8 t70 -57.5 -22.11 41.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.237 -179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 118' ' ' LYS . 19.6 mm -64.66 -52.43 54.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.971 0.415 . . . . 0.0 110.746 179.851 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -77.64 -22.47 50.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.249 -179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -85.54 -37.36 19.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.275 -179.657 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.584 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 3.7 tp -72.67 -47.12 50.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.945 0.402 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.486 ' HG3' HD13 ' A' ' 114' ' ' LEU . 0.0 OUTLIER -46.58 -29.83 2.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.109 179.877 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -27.35 62.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.748 179.753 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.31 -51.06 11.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.964 -179.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 148' ' ' ILE . . . -54.01 -65.14 3.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.446 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -85.99 101.04 12.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.872 0.368 . . . . 0.0 110.774 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.29 35.32 4.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 33.5 m-20 -116.91 8.46 13.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.239 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 60.82 46.68 8.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.865 0.364 . . . . 0.0 110.995 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -124.68 -43.51 2.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.26 14.44 8.33 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.691 -179.957 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 33.0 mtm180 -157.41 153.78 27.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.735 HD13 ' N ' ' A' ' 149' ' ' ASP . 0.0 OUTLIER -115.95 130.17 71.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.553 179.899 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.735 ' N ' HD13 ' A' ' 148' ' ' ILE . 3.1 p30 -115.64 167.6 10.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.114 0.483 . . . . 0.0 111.747 -179.046 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.64 ' HD1' HD21 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -35.7 -53.53 0.71 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.133 -179.829 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -48.17 -44.82 32.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.362 -179.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.518 ' C ' HD11 ' A' ' 148' ' ' ILE . 2.1 mt-10 -83.58 -28.43 28.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.101 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.719 ' N ' HD11 ' A' ' 148' ' ' ILE . 4.5 t80 -59.79 -51.27 70.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.878 0.37 . . . . 0.0 110.877 -179.892 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.659 ' CB ' HD13 ' A' ' 97' ' ' LEU . 1.9 mt -53.36 -21.87 6.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.257 -179.628 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -74.02 -23.04 59.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.88 0.371 . . . . 0.0 110.519 179.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.584 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.7 OUTLIER -59.23 -52.11 67.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.703 179.78 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.665 ' HG2' HD11 ' A' ' 97' ' ' LEU . 1.5 ppp? -69.73 -26.31 64.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.042 -179.868 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.14 -36.74 19.92 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.842 0.353 . . . . 0.0 110.965 -179.975 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -60.22 -34.32 83.88 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.094 179.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.623 HG22 ' HG3' ' B' ' 135' ' ' ARG . 54.8 t -57.64 -27.99 31.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.997 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.91 179.923 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.789 0.328 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 15.5 tt0 -85.31 84.46 7.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . 0.489 ' O ' ' O ' ' B' ' 131' ' ' ILE . 35.4 mtmt 60.99 -171.41 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.849 HD12 ' HB2' ' B' ' 135' ' ' ARG . 6.2 mm 54.12 135.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.411 0.624 . . . . 0.0 112.257 179.354 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.536 ' H ' HD12 ' B' ' 134' ' ' LEU . 34.4 p90 -179.47 114.63 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.632 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 55.83 23.67 6.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.925 0.393 . . . . 0.0 110.525 -179.52 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.536 HD12 ' H ' ' B' ' 132' ' ' PHE . 1.3 mt -124.81 -51.03 1.71 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.478 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.849 ' HB2' HD12 ' B' ' 131' ' ' ILE . 42.7 ttt180 -54.27 -43.14 70.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.982 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.88 154.78 52.58 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.339 -179.959 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.59 23.46 12.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.965 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.535 ' HE2' HD13 ' A' ' 100' ' ' LEU . 8.7 m-85 -130.76 24.7 5.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.836 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.49 -30.82 6.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.411 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.1 OUTLIER 63.29 136.38 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.735 -179.818 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.411 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 85.0 Cg_endo -88.19 160.96 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.727 2.285 . . . . 0.0 112.568 -179.821 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.02 -65.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.893 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 5.9 mt -144.87 -54.33 0.31 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.948 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -68.27 176.04 2.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.876 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -136.89 -47.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.906 179.986 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 1.5 t -108.11 155.24 9.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.843 179.888 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.89 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.01 151.47 23.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.52 -119.93 1.67 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.527 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 60.63 32.14 20.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 0.0 110.934 -179.957 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 t -132.53 -45.85 0.89 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.983 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.49 -31.85 68.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.932 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -60.35 -31.3 70.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.955 -179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -59.38 -55.9 28.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.88 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.825 HD23 ' CZ ' ' A' ' 153' ' ' PHE . 1.3 mt -62.55 -35.35 79.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.932 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.4 t -50.76 -38.4 47.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -84.57 -29.95 25.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.919 179.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.495 HD13 ' HE1' ' B' ' 138' ' ' PHE . 35.0 mt -66.98 -42.16 85.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.003 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.413 ' CD1' ' CD2' ' A' ' 153' ' ' PHE . 5.1 t80 -58.24 -51.32 70.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -58.27 -26.47 63.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.296 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 11.4 ttp -92.52 -31.15 15.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.233 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.435 ' CE1' ' HB ' ' A' ' 119' ' ' ILE . 0.3 OUTLIER -79.24 -39.73 32.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.141 -179.711 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -60.78 -71.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.25 10.32 5.49 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.546 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 108' ' ' ALA . 9.3 t30 -110.67 -21.78 11.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.247 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 107' ' ' ASN . . . 68.23 39.59 2.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 p-10 -116.47 -46.47 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.744 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.01 4.18 12.72 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.077 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' A' ' 148' ' ' ILE . 2.5 m-85 -143.4 162.7 35.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.923 0.362 . . . . 0.0 110.98 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 116' ' ' GLU . 14.2 mt -116.54 137.93 48.76 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 120.864 0.364 . . . . 0.0 111.18 179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -126.97 -166.62 1.62 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.777 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 134' ' ' GLU . 0.2 OUTLIER -57.04 -31.11 64.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.912 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . . . -61.69 -62.31 1.89 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 112' ' ' ILE . 1.4 mp0 -63.58 -29.59 70.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.752 ' HB3' HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -52.06 -31.32 29.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.714 179.849 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.459 ' HA ' HD12 ' A' ' 133' ' ' ILE . 0.0 OUTLIER -56.43 -34.63 66.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.145 179.335 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.528 HD12 ' O ' ' A' ' 116' ' ' GLU . 11.0 mt -53.92 -28.44 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.949 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.709 ' HG3' HD13 ' A' ' 117' ' ' LEU . 0.5 OUTLIER -69.38 -34.1 74.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.425 179.604 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.803 HD13 ' OG1' ' A' ' 124' ' ' THR . 0.1 OUTLIER -68.51 -30.66 69.52 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.974 179.951 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.68 -30.85 14.69 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.998 0.427 . . . . 0.0 110.726 179.853 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.98 -25.09 62.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.912 179.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.803 ' OG1' HD13 ' A' ' 121' ' ' LEU . 0.9 OUTLIER -100.96 -64.31 1.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.242 -179.507 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 72.58 41.65 50.33 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.295 -179.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.477 ' O ' HG23 ' A' ' 129' ' ' THR . 3.7 tt0 -118.57 -164.04 1.0 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.963 -179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 8.7 t -78.5 -7.65 57.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.513 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.729 HG13 HD11 ' A' ' 121' ' ' LEU . 8.5 pt -62.36 -16.49 16.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.581 0.229 . . . . 0.0 111.521 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.504 HG22 ' HG ' ' A' ' 121' ' ' LEU . 75.3 p -43.06 154.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.635 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 69.52 -64.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.22 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.52 -59.1 5.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.887 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.45 -23.09 56.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.982 179.903 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.752 HG23 ' HB3' ' A' ' 117' ' ' LEU . 21.1 mm -61.74 -50.3 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.949 0.404 . . . . 0.0 110.895 179.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.604 ' HG2' HD21 ' A' ' 114' ' ' LEU . 0.1 OUTLIER -72.61 -26.17 61.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.267 -179.699 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -76.9 -45.35 28.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.378 -179.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 156' ' ' PHE . 2.9 tp -68.46 -46.17 70.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.699 -179.888 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -46.46 -33.86 4.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.209 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -57.37 -27.63 62.46 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.912 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -73.84 -51.31 16.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.989 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -57.58 -66.2 3.01 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.39 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.82 97.82 6.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.869 0.366 . . . . 0.0 110.813 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.71 33.66 5.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.928 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 18.7 m-20 -114.61 4.79 15.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.337 -179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 9.1 t30 60.42 39.84 18.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -123.21 -42.42 2.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.884 179.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.88 20.64 5.97 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.66 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . 1.7 mtm105 -152.39 141.09 20.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . 0.787 HD11 ' N ' ' A' ' 153' ' ' PHE . 0.0 OUTLIER -115.89 133.6 61.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.308 179.785 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 148' ' ' ILE . 23.7 t70 -115.61 164.42 14.35 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.014 0.435 . . . . 0.0 111.876 -178.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 150' ' ' TYR . . . . . 0.964 ' CE1' HD21 ' A' ' 154' ' ' LEU . 3.6 t80 -36.92 -35.02 0.09 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.946 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.08 -68.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.716 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.432 ' C ' HD11 ' A' ' 148' ' ' ILE . 4.9 mt-10 -58.98 -26.56 64.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.747 179.713 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.825 ' CZ ' HD23 ' A' ' 97' ' ' LEU . 2.0 t80 -56.66 -39.67 74.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.508 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.964 HD21 ' CE1' ' A' ' 150' ' ' TYR . 7.5 mt -63.22 -17.7 62.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.019 179.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' A' ' 158' ' ' LYS . 32.2 tt0 -69.88 -23.08 63.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.015 0.436 . . . . 0.0 110.409 179.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 136' ' ' LEU . 0.2 OUTLIER -58.91 -58.74 7.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.754 179.594 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.74 ' HG2' HD21 ' A' ' 97' ' ' LEU . 32.9 mmm -57.67 -35.83 71.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.914 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 155' ' ' GLU . 0.0 OUTLIER -42.46 -30.91 0.37 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.351 -179.602 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.81 28.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.194 179.512 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 160' ' ' VAL . . . . . 0.767 HG22 ' HG3' ' B' ' 135' ' ' ARG . 21.7 t -62.66 -22.89 31.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.755 0.312 . . . . 0.0 111.252 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . 0.456 HG22 ' CD1' ' B' ' 132' ' ' PHE . 1.2 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.819 0.342 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 68.5 -68.43 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.972 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 130' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -130.92 -43.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 131' ' ' ILE . . . . . 0.454 ' N ' HD12 ' B' ' 131' ' ' ILE . 0.1 OUTLIER -135.02 168.53 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.733 179.596 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 132' ' ' PHE . . . . . 0.63 ' CE2' HD11 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -146.83 -96.06 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.773 -179.347 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 133' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.1 14.09 6.81 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.779 0.323 . . . . 0.0 111.06 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 132' ' ' PHE . 3.5 mp -105.9 -50.78 3.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.094 0.473 . . . . 0.0 110.379 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.767 ' HG3' HG22 ' A' ' 160' ' ' VAL . 33.7 ttt-85 -54.5 -34.83 62.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.056 -179.956 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -85.43 14.66 49.76 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.941 -179.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 137' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -137.52 14.15 2.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.799 0.333 . . . . 0.0 110.718 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 138' ' ' PHE . . . . . 0.495 ' HE1' HD13 ' A' ' 100' ' ' LEU . 3.1 m-85 -110.65 30.68 6.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.702 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.99 159.25 44.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 140' ' ' ARG . . . . . 0.408 ' HG2' ' HD2' ' B' ' 141' ' ' PRO . 0.0 OUTLIER 62.91 133.46 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.728 -179.887 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . 0.408 ' HD2' ' HG2' ' B' ' 140' ' ' ARG . 52.8 Cg_exo -55.14 100.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.437 2.091 . . . . 0.0 112.235 -179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 142' ' ' THR . . . . . 0.408 ' O ' ' N ' ' B' ' 144' ' ' ARG . 0.7 OUTLIER -90.95 11.62 22.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.397 -179.909 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 143' ' ' LEU . . . . . 0.511 HD22 ' HD3' ' B' ' 145' ' ' ARG . 23.5 mt 62.89 -77.15 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.753 0.311 . . . . 0.0 111.116 179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 144' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' B' ' 142' ' ' THR . 1.6 tpt180 68.22 41.19 1.97 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.855 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.511 ' HD3' HD22 ' B' ' 143' ' ' LEU . 0.6 OUTLIER -137.97 42.21 2.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.805 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 60.22 155.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.132 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 147' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.935 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_