data_2mkp_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 2mkp _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.771 ' O ' HG11 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.771 HG11 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.566 ' H ' ' CG1' ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . 0.473 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 1.283 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 1.095 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . 0.479 ' HB2' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' C' ' 72' ' ' VAL . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.491 ' O ' ' OG1' ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.475 ' O ' HG13 ' C' ' 44' ' ' VAL . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.57 HG22 ' N ' ' C' ' 45' ' ' MET . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.57 ' N ' HG22 ' C' ' 44' ' ' VAL . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.487 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.583 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.583 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.465 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . 0.413 ' HA ' HD11 ' C' ' 57' ' ' LEU . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.811 ' O ' ' HG3' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 60' ' ' MET . . . . . 0.811 ' HG3' ' O ' ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.564 ' N ' ' HE1' ' C' ' 60' ' ' MET . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.405 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.75 HG22 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 69' ' ' SER . . . . . 0.419 ' HG ' ' H ' ' C' ' 71' ' ' THR . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.56 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.419 ' H ' ' HG ' ' C' ' 69' ' ' SER . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.549 ' HB ' HG21 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.444 ' N ' HG13 ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.546 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.75 ' O ' HG22 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' C' ' 74' ' ' PHE . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.462 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.501 ' CG1' ' N ' ' C' ' 83' ' ' ARG . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.816 0.341 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.689 ' N ' HD12 ' I' ' 122' ' ' LEU . 1.6 mp . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' C' ' 26' ' ' ILE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 1.045 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.799 HG12 ' O ' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.912 ' O ' HG23 ' C' ' 38' ' ' THR . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.912 HG23 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.759 ' H ' HD12 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.496 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' C' ' 51' ' ' ASN . 2.9 t30 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.894 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . 0.571 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.649 HG13 ' N ' ' C' ' 62' ' ' ASP . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.649 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.633 HG11 ' N ' ' C' ' 73' ' ' ASP . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.633 ' N ' HG11 ' C' ' 72' ' ' VAL . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.566 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.502 ' C ' ' O ' ' C' ' 77' ' ' PHE . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.522 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.673 ' SD ' ' O ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.522 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 85' ' ' MET . . . . . 0.594 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . 0.594 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.318 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' I' I ' 121' ' ' MET . . . . . 0.427 ' O ' ' HG2' ' I' ' 121' ' ' MET . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.609 HD11 ' N ' ' I' ' 122' ' ' LEU . 2.0 mp . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.659 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . 0.659 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.423 ' O ' ' HB3' ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.697 ' O ' ' CD2' ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.0 mm-40 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' C' ' 16' ' ' GLN . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 1.005 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.831 HG12 ' O ' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.893 ' O ' HG23 ' C' ' 38' ' ' THR . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.895 ' OG1' ' CB ' ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.763 ' N ' HD13 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.504 ' CG2' ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.544 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.595 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.476 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.557 ' CG2' ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.646 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.557 ' O ' ' CG2' ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.65 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.496 ' O ' HD11 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.496 HD11 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.561 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.772 0.32 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.603 HD11 ' N ' ' I' ' 122' ' ' LEU . 2.6 mp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.564 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.433 ' O ' ' N ' ' C' ' 19' ' ' GLU . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' C' ' 16' ' ' GLN . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.99 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.66 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.487 ' O ' ' OG1' ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.487 ' OG1' ' O ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.449 ' O ' HG23 ' C' ' 44' ' ' VAL . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.519 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.486 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.415 ' H ' ' CD ' ' C' ' 50' ' ' GLN . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.454 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.435 ' C ' ' O ' ' C' ' 56' ' ' GLU . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.511 HG23 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . 0.465 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.71 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.511 ' O ' HG23 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.606 HG13 ' N ' ' C' ' 73' ' ' ASP . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.606 ' N ' HG13 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.71 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' C' ' 81' ' ' MET . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.501 ' O ' HG23 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.542 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.501 HG23 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 85' ' ' MET . . . . . 0.547 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . 0.547 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.779 0.323 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.642 ' N ' HD13 ' I' ' 122' ' ' LEU . 2.4 mp . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.497 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 13' ' ' THR . . . . . 0.454 ' HG1' ' H ' ' C' ' 15' ' ' GLU . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . 0.454 ' H ' ' HG1' ' C' ' 13' ' ' THR . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . 0.961 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.961 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 0.943 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 1.314 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . 0.606 ' HB2' ' CG2' ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.707 ' O ' HG22 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 1.122 HD13 ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.69 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.94 ' OG1' ' HB3' ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.439 ' O ' HG11 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.515 HG22 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.547 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' C' ' 45' ' ' MET . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.529 HE21 ' CD2' ' C' ' 48' ' ' LEU . 3.9 pt20 -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.452 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.2 OUTLIER -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.547 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.94 ' HB3' ' OG1' ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 60' ' ' MET . . . . . 0.456 ' SD ' ' N ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.567 HG22 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.545 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.567 ' O ' HG22 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.798 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.447 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.472 ' C ' ' O ' ' C' ' 77' ' ' PHE . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.797 0.332 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' I' I ' 121' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' I' ' 121' ' ' MET . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.718 ' N ' HD12 ' I' ' 122' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . 0.563 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.691 ' CG1' ' O ' ' C' ' 5' ' ' TYR . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.646 ' N ' ' CG2' ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' C' ' 19' ' ' GLU . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' C' ' 33' ' ' ASP . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.73 ' CD1' ' C ' ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 1.11 ' O ' HG23 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 1.11 HG23 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.416 ' O ' HG21 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.444 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.504 HG21 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.465 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.644 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.644 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.531 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . 0.822 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 60' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.822 ' CG2' ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.492 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.609 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.687 ' H ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.449 ' N ' HG12 ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.609 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.425 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.492 ' O ' HG21 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.596 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.598 ' N ' HD13 ' I' ' 122' ' ' LEU . 2.2 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.723 ' O ' HG23 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.723 HG23 ' O ' ' C' ' 6' ' ' LYS . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.614 ' H ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.67 ' CD2' ' O ' ' C' ' 9' ' ' VAL . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' C' ' 16' ' ' GLN . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 0.5 ' CE2' ' CD2' ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.761 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . 0.707 ' HB1' ' CG2' ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.752 ' O ' ' CG2' ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.504 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.502 ' O ' ' OG1' ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.519 HG23 ' HB3' ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.526 ' O ' HG21 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.498 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.615 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.633 ' HG2' ' CD ' ' C' ' 52' ' ' PRO . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.491 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.633 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.519 ' HB3' HG23 ' C' ' 38' ' ' THR . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . 0.549 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.582 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . 0.575 ' OE2' ' CG ' ' C' ' 80' ' ' MET . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.639 ' O ' HD12 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.566 ' O ' ' OD1' ' C' ' 73' ' ' ASP . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' C' ' 81' ' ' MET . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.529 ' O ' HG23 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.728 ' SD ' ' O ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.657 ' N ' HD12 ' I' ' 122' ' ' LEU . 1.3 mp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.616 ' O ' HG11 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.69 ' O ' HG21 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.69 HG21 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.674 ' H ' HG21 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' C' ' 16' ' ' GLN . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 0.409 ' C ' ' O ' ' C' ' 23' ' ' ALA . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 0.587 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.465 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.467 ' CB ' ' HG1' ' C' ' 71' ' ' THR . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.675 HG22 ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.47 ' O ' ' OG1' ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.647 ' HG1' ' N ' ' C' ' 39' ' ' LYS . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.647 ' N ' ' HG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.587 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 1.144 ' CD2' ' N ' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.683 HG21 ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.683 ' N ' HG21 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.477 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.519 ' O ' ' CD2' ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.6 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 2.5 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.6 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 4.2 t30 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.66 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.581 ' CD2' ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.441 ' N ' HG21 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' C' ' 35' ' ' CYS . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.648 HG11 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.957 ' O ' HD22 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . 0.704 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.649 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.957 HD22 ' O ' ' C' ' 74' ' ' PHE . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.867 ' N ' ' CD1' ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.615 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.797 0.332 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.574 ' N ' HD12 ' I' ' 122' ' ' LEU . 2.5 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.648 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . 0.648 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.734 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.734 HG22 ' O ' ' C' ' 6' ' ' LYS . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.624 ' H ' HG22 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.672 ' CD2' ' O ' ' C' ' 9' ' ' VAL . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . 0.408 ' CD ' ' O ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' C' ' 19' ' ' GLU . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' C' ' 16' ' ' GLN . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.496 HG22 ' O ' ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 0.891 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.422 ' O ' HG23 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.497 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.544 ' N ' ' O ' ' C' ' 45' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.44 HD22 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.522 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.884 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . . . . . . . . . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.578 ' OD1' ' C ' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.844 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.536 HG11 ' N ' ' C' ' 73' ' ' ASP . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . 0.536 ' N ' HG11 ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.565 ' CD1' ' C ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 80' ' ' MET . . . . . 0.586 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.631 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.85 0.357 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.799 ' N ' HD12 ' I' ' 122' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 1' ' ' MET . . . . . 0.429 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 2' ' ' ASP . . . . . 0.657 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 3' ' ' ASP . . . . . 0.657 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 5' ' ' TYR . . . . . 0.493 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 6' ' ' LYS . . . . . 0.728 ' O ' HG21 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 9' ' ' VAL . . . . . 0.728 HG21 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 10' ' ' GLU . . . . . 0.588 ' H ' ' CG2' ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 12' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 19' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 27' ' ' PHE . . . . . 0.743 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 28' ' ' VAL . . . . . 0.765 ' CG2' ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 31' ' ' ALA . . . . . 0.741 ' HB1' ' CG2' ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 35' ' ' CYS . . . . . 0.765 ' O ' ' CG2' ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 36' ' ' ILE . . . . . 0.541 ' O ' ' OG1' ' C' ' 71' ' ' THR . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 37' ' ' SER . . . . . 1.127 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 38' ' ' THR . . . . . 1.127 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 40' ' ' GLU . . . . . 0.743 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . 0.516 ' O ' HG22 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 42' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 44' ' ' VAL . . . . . 0.662 HG21 ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 45' ' ' MET . . . . . 0.662 ' N ' HG21 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 48' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 50' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 51' ' ' ASN . . . . . 0.517 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.1 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 52' ' ' PRO . . . . . 0.644 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 53' ' ' THR . . . . . 0.433 ' H ' ' HG1' ' C' ' 53' ' ' THR . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 58' ' ' GLN . . . . . 0.658 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 61' ' ' ILE . . . . . 0.686 HD12 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 62' ' ' ASP . . . . . 0.631 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 64' ' ' VAL . . . . . 0.598 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 70' ' ' GLY . . . . . 0.686 ' O ' HD12 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 71' ' ' THR . . . . . 0.665 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 72' ' ' VAL . . . . . 0.436 ' H ' HG13 ' C' ' 72' ' ' VAL . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 74' ' ' PHE . . . . . 0.875 ' CE2' ' CZ ' ' C' ' 24' ' ' PHE . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 76' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 78' ' ' LEU . . . . . 0.764 ' CD1' ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 79' ' ' VAL . . . . . 0.519 ' O ' HG21 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 81' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 82' ' ' VAL . . . . . 0.519 HG21 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 42.1 t0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.812 0.339 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' I' I ' 122' ' ' LEU . . . . . 0.643 ' N ' HD13 ' I' ' 122' ' ' LEU . 1.5 mp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.771 ' O ' HG11 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.771 HG11 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.566 ' H ' ' CG1' ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . 0.473 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 1.283 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 1.095 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . 0.479 ' HB2' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.549 HG21 ' HB ' ' C' ' 72' ' ' VAL . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.491 ' O ' ' OG1' ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.475 ' O ' HG13 ' C' ' 44' ' ' VAL . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.57 HG22 ' N ' ' C' ' 45' ' ' MET . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.57 ' N ' HG22 ' C' ' 44' ' ' VAL . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.487 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.583 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.583 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.465 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . 0.413 ' HA ' HD11 ' C' ' 57' ' ' LEU . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.811 ' O ' ' HG3' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 60' ' ' MET . . . . . 0.811 ' HG3' ' O ' ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.564 ' N ' ' HE1' ' C' ' 60' ' ' MET . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.405 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.75 HG22 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 69' ' ' SER . . . . . 0.419 ' HG ' ' H ' ' C' ' 71' ' ' THR . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.56 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.419 ' H ' ' HG ' ' C' ' 69' ' ' SER . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.549 ' HB ' HG21 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.444 ' N ' HG13 ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.546 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.75 ' O ' HG22 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' C' ' 74' ' ' PHE . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.462 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.501 ' CG1' ' N ' ' C' ' 83' ' ' ARG . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . 0.576 ' NE ' ' OE1' ' C' ' 50' ' ' GLN . 51.5 ttt85 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.476 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 58.36 130.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.557 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -94.6 143.54 26.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.455 ' O ' HD12 ' I' ' 122' ' ' LEU . . . -43.51 -35.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -57.73 -42.43 83.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.562 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.586 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.689 ' N ' HD12 ' I' ' 122' ' ' LEU . 1.6 mp -91.51 -21.45 20.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.645 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 91.3 mttt -82.56 -46.02 13.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.551 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . 0.516 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -80.47 -84.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.579 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.586 ' HB2' ' O ' ' I' ' 121' ' ' MET . 8.1 mp -30.6 -51.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.593 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.623 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -135.34 70.71 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.577 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.645 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -72.92 -29.35 65.16 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 33.3 t -81.25 152.65 27.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.59 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 38.1 tttp 56.8 34.25 24.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . 0.425 ' HE2' ' HE2' ' I' ' 131' ' ' LYS . 80.2 t60 -129.64 134.05 47.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . 0.425 ' HE2' ' HE2' ' I' ' 130' ' ' HIS . 50.7 mttm . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.592 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' C' ' 26' ' ' ILE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 1.045 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.799 HG12 ' O ' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.912 ' O ' HG23 ' C' ' 38' ' ' THR . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.912 HG23 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.759 ' H ' HD12 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.496 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' C' ' 51' ' ' ASN . 2.9 t30 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.894 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . 0.571 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.649 HG13 ' N ' ' C' ' 62' ' ' ASP . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.649 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.633 HG11 ' N ' ' C' ' 73' ' ' ASP . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.633 ' N ' HG11 ' C' ' 72' ' ' VAL . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.488 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.566 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.502 ' C ' ' O ' ' C' ' 77' ' ' PHE . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.522 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.673 ' SD ' ' O ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.522 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . 0.433 ' SG ' ' CB ' ' I' ' 118' ' ' ALA . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 85' ' ' MET . . . . . 0.594 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . 0.594 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 78.4 mtm-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.613 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -151.15 96.56 2.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 32.7 m -61.34 142.04 57.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.524 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.484 ' O ' HD11 ' I' ' 122' ' ' LEU . . . -49.56 -32.6 12.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.582 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -58.33 -44.1 88.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.548 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.622 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.609 HD11 ' N ' ' I' ' 122' ' ' LEU . 2.0 mp -86.83 -25.39 24.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.496 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 66.7 mttm -80.31 -46.3 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.512 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . 0.518 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -77.0 -84.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.557 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' I' ' 121' ' ' MET . 9.0 mp -29.81 -50.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.595 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.586 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.1 OUTLIER -133.37 79.24 1.82 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.557 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.703 ' O ' ' N ' ' I' ' 129' ' ' LYS . . . -80.14 -168.97 38.72 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 1.1 t 55.09 -67.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . 0.703 ' N ' ' O ' ' I' ' 127' ' ' GLY . 53.2 mttp -83.0 130.17 35.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.577 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . 0.693 ' CG ' ' H ' ' I' ' 131' ' ' LYS . 1.4 t-80 -165.38 -136.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . 0.693 ' H ' ' CG ' ' I' ' 130' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.592 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.659 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . 0.659 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.423 ' O ' ' HB3' ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.697 ' O ' ' CD2' ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.682 HE22 ' HZ1' ' I' ' 131' ' ' LYS . 91.0 mm-40 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.526 ' OE2' ' NZ ' ' I' ' 131' ' ' LYS . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 1.005 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.831 HG12 ' O ' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.893 ' O ' HG23 ' C' ' 38' ' ' THR . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.895 ' OG1' ' CB ' ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.763 ' N ' HD13 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.504 ' CG2' ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.544 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.595 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.595 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.476 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.557 ' CG2' ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.646 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.557 ' O ' ' CG2' ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.65 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.496 ' O ' HD11 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.496 HD11 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.561 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . 0.571 ' SG ' ' NH2' ' I' ' 115' ' ' ARG . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . 0.571 ' NH2' ' SG ' ' C' ' 84' ' ' CYS . 67.2 ttt180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.65 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -89.9 113.84 25.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.533 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.9 t -73.41 138.17 45.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.598 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . . . . . . . . . . . -44.74 -38.75 4.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -60.91 -44.39 97.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.631 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.603 HD11 ' N ' ' I' ' 122' ' ' LEU . 2.6 mp -77.31 -27.99 53.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.696 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 43.8 mtpt -72.96 -42.71 63.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.56 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -83.23 -74.85 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.549 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' I' ' 121' ' ' MET . 9.9 mp -42.7 -45.33 4.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.599 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 9.5 mp -106.78 24.52 12.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.696 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -58.71 -33.19 71.59 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 21.9 t -63.46 -42.78 98.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.584 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' I' ' 126' ' ' LEU . 92.0 mttt -131.66 128.88 39.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . 0.722 ' HD1' ' H ' ' I' ' 131' ' ' LYS . 0.6 OUTLIER -144.63 162.54 36.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . 0.722 ' H ' ' HD1' ' I' ' 130' ' ' HIS . 67.3 mttm . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.577 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.564 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.564 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.433 ' O ' ' N ' ' C' ' 19' ' ' GLU . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . 0.647 HD22 ' NZ ' ' I' ' 129' ' ' LYS . 46.7 t30 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' C' ' 16' ' ' GLN . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.99 ' CG1' ' O ' ' C' ' 24' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.66 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.487 ' O ' ' OG1' ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.487 ' OG1' ' O ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.449 ' O ' HG23 ' C' ' 44' ' ' VAL . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.519 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.486 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.415 ' H ' ' CD ' ' C' ' 50' ' ' GLN . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.454 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.435 ' C ' ' O ' ' C' ' 56' ' ' GLU . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.511 HG23 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . 0.624 ' CD ' HH22 ' I' ' 115' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.71 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.511 ' O ' HG23 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.606 HG13 ' N ' ' C' ' 73' ' ' ASP . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.606 ' N ' HG13 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.71 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.542 ' O ' ' HB2' ' C' ' 81' ' ' MET . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.501 ' O ' HG23 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.542 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.501 HG23 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . 0.643 ' O ' ' HB1' ' I' ' 118' ' ' ALA . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 85' ' ' MET . . . . . 0.547 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . 0.547 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . 0.624 HH22 ' CD ' ' C' ' 63' ' ' GLU . 53.5 ttt85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.624 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -94.3 106.47 18.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.596 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -64.97 137.92 58.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.566 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.643 ' HB1' ' O ' ' C' ' 84' ' ' CYS . . . -48.82 -32.31 8.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -66.93 -41.82 86.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.559 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.66 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.642 ' N ' HD13 ' I' ' 122' ' ' LEU . 2.4 mp -82.7 -21.55 34.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.576 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 42.5 mttm -77.61 -45.47 25.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.517 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . 0.512 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -83.08 -80.42 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.559 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.66 ' HB2' ' O ' ' I' ' 121' ' ' MET . 8.5 mp -31.2 -49.74 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.532 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.557 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -139.53 72.41 1.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.531 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.576 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -84.5 -27.94 34.34 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 26.1 t -71.54 -39.95 70.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.773 0.32 . . . . 0.0 110.572 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . 0.647 ' NZ ' HD22 ' C' ' 18' ' ' ASN . 13.5 tptm -85.87 -69.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 45.71 -141.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.588 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 62.9 tttt . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.602 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.497 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' THR . . . . . 0.454 ' HG1' ' H ' ' C' ' 15' ' ' GLU . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . 0.454 ' H ' ' HG1' ' C' ' 13' ' ' THR . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . 0.961 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.961 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 0.943 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 1.314 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.707 HG22 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . 0.606 ' HB2' ' CG2' ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.707 ' O ' HG22 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 1.122 HD13 ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.69 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.94 ' OG1' ' HB3' ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.439 ' O ' HG11 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.515 HG22 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.547 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.539 ' N ' ' O ' ' C' ' 45' ' ' MET . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.529 HE21 ' CD2' ' C' ' 48' ' ' LEU . 3.9 pt20 -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.452 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.2 OUTLIER -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.547 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.94 ' HB3' ' OG1' ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 60' ' ' MET . . . . . 0.456 ' SD ' ' N ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.567 HG22 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.545 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.567 ' O ' HG22 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.798 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.447 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.472 ' C ' ' O ' ' C' ' 77' ' ' PHE . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 37.0 ptt-85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' C' ' 48' ' ' LEU . 5.5 ptt? -100.45 143.86 30.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.566 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 46.9 p -99.38 147.27 25.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.414 ' O ' HD12 ' I' ' 122' ' ' LEU . . . -46.57 -41.85 15.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.551 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -60.04 -42.12 93.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.587 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' I' ' 121' ' ' MET . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.718 ' N ' HD12 ' I' ' 122' ' ' LEU . 0.8 OUTLIER -87.52 -26.78 23.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.603 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 13.6 mtpp -68.47 -48.71 63.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -75.01 -72.23 0.31 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.628 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 8.0 mt -42.48 -45.48 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.55 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.696 ' C ' ' O ' ' I' ' 122' ' ' LEU . 0.3 OUTLIER -155.79 77.97 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.54 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.603 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -104.84 1.95 41.62 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 91.4 p -81.26 -36.55 29.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.792 0.329 . . . . 0.0 110.587 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -109.04 -6.6 15.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.589 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . 0.508 ' HB2' ' O ' ' I' ' 126' ' ' LEU . 46.4 t60 -59.31 -41.68 89.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . 0.456 ' OXT' ' O ' ' I' ' 130' ' ' HIS . 18.8 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.554 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . 0.563 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.691 ' CG1' ' O ' ' C' ' 5' ' ' TYR . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.646 ' N ' ' CG2' ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.453 ' O ' ' N ' ' C' ' 19' ' ' GLU . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . . . . . . . . . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.471 ' SG ' ' OD2' ' C' ' 33' ' ' ASP . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.73 ' CD1' ' C ' ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 1.11 ' O ' HG23 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 1.11 HG23 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.416 ' O ' HG21 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.444 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.504 HG21 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.465 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.644 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.644 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.531 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . 0.822 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 60' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.822 ' CG2' ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.492 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.609 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.687 ' H ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.449 ' N ' HG12 ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.609 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.425 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.529 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.492 ' O ' HG21 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.596 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.587 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -90.79 106.0 18.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.564 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 19.9 t -67.54 139.51 56.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.543 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.416 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -48.56 -31.64 6.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.536 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -63.69 -43.57 96.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.501 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.505 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.598 ' N ' HD13 ' I' ' 122' ' ' LEU . 2.2 mp -85.24 -29.51 24.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.7 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 86.6 mttt -73.03 -41.75 63.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.83 -76.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.564 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' I' ' 121' ' ' MET . 9.5 mp -45.32 -47.11 13.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.593 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 9.8 mp -106.0 35.0 3.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.7 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -62.83 -33.61 87.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 18.9 t -59.34 -42.55 91.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.333 . . . . 0.0 110.535 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.31 126.65 23.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.565 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -168.13 143.92 3.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.558 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.959 -1.019 . . . . 0.0 110.565 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.723 ' O ' HG23 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.723 HG23 ' O ' ' C' ' 6' ' ' LYS . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.614 ' H ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.67 ' CD2' ' O ' ' C' ' 9' ' ' VAL . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' C' ' 16' ' ' GLN . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 0.5 ' CE2' ' CD2' ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.761 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . 0.707 ' HB1' ' CG2' ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.752 ' O ' ' CG2' ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.504 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.502 ' O ' ' OG1' ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.519 HG23 ' HB3' ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.526 ' O ' HG21 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.498 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.615 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.633 ' HG2' ' CD ' ' C' ' 52' ' ' PRO . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.491 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.491 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.633 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.519 ' HB3' HG23 ' C' ' 38' ' ' THR . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . 0.549 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.639 HD12 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.582 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . 0.575 ' OE2' ' CG ' ' C' ' 80' ' ' MET . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.639 ' O ' HD12 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.566 ' O ' ' OD1' ' C' ' 73' ' ' ASP . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' C' ' 81' ' ' MET . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.529 ' O ' HG23 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.728 ' SD ' ' O ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.529 HG23 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . 0.424 ' NH1' ' O ' ' I' ' 116' ' ' MET . 63.9 ttt-85 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.456 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 2.4 ptt? -102.46 147.02 27.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.543 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 25.6 m -114.82 146.86 40.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.568 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . . . . . . . . . . . -46.13 -37.16 6.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -62.86 -44.7 95.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.581 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 126' ' ' LEU . 1.3 mp -79.9 -27.3 39.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.414 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 73.5 mttt -74.56 -49.47 21.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.573 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.26 -75.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.574 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' I' ' 121' ' ' MET . 10.7 mp -41.17 -51.3 3.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -137.62 85.1 2.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.538 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.414 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -96.68 172.01 28.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 73.02 -52.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.786 0.326 . . . . 0.0 110.567 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -78.37 -2.41 38.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.566 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -114.48 136.7 52.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.556 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 57.5 mttp . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.506 -179.953 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.616 ' O ' HG11 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.69 ' O ' HG21 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.69 HG21 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.674 ' H ' HG21 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' C' ' 16' ' ' GLN . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 0.409 ' C ' ' O ' ' C' ' 23' ' ' ALA . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 0.587 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.465 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.467 ' CB ' ' HG1' ' C' ' 71' ' ' THR . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.675 HG22 ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.47 ' O ' ' OG1' ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.647 ' HG1' ' N ' ' C' ' 39' ' ' LYS . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.647 ' N ' ' HG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.587 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 1.144 ' CD2' ' N ' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.683 HG21 ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.683 ' N ' HG21 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.477 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.519 ' O ' ' CD2' ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.6 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 2.5 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.6 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 4.2 t30 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.66 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.581 ' CD2' ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.441 ' N ' HG21 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.467 ' HG1' ' CB ' ' C' ' 35' ' ' CYS . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.648 HG11 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.957 ' O ' HD22 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . 0.704 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.649 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.957 HD22 ' O ' ' C' ' 74' ' ' PHE . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.867 ' N ' ' CD1' ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.615 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.501 ' C ' ' SD ' ' I' ' 116' ' ' MET . 0.0 OUTLIER -98.44 137.56 36.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.527 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -109.34 145.79 35.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.605 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.42 ' O ' HD12 ' I' ' 122' ' ' LEU . . . -46.24 -36.08 5.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -62.72 -43.16 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.531 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.574 ' N ' HD12 ' I' ' 122' ' ' LEU . 2.5 mp -80.67 -33.49 35.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.769 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 9.7 mtmp? -75.01 -41.62 59.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.529 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.75 -69.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.57 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' I' ' 121' ' ' MET . 9.6 mp -57.62 -46.69 83.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.535 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 8.4 mt -107.8 41.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.561 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.769 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -64.67 -29.71 75.95 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 72.2 p -100.91 -29.76 12.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.756 0.312 . . . . 0.0 110.543 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -99.88 16.34 24.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -54.21 -40.31 67.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.604 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.648 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . 0.648 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.734 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.734 HG22 ' O ' ' C' ' 6' ' ' LYS . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.624 ' H ' HG22 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.672 ' CD2' ' O ' ' C' ' 9' ' ' VAL . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . 0.408 ' CD ' ' O ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' C' ' 19' ' ' GLU . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . 0.486 ' OD1' ' NZ ' ' I' ' 129' ' ' LYS . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' C' ' 16' ' ' GLN . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.496 HG22 ' O ' ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.844 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 0.891 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.422 ' O ' HG23 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.497 HG23 ' N ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.544 ' N ' ' O ' ' C' ' 45' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.44 HD22 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.522 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.884 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . . . . . . . . . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.578 ' OD1' ' C ' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.844 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.536 HG11 ' N ' ' C' ' 73' ' ' ASP . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . 0.536 ' N ' HG11 ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.565 ' CD1' ' C ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 80' ' ' MET . . . . . 0.586 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.631 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' I' ' 116' ' ' MET . 83.7 mtm-85 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.519 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 55.95 125.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.561 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 73.7 m -76.06 19.53 0.22 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.61 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' C' ' 84' ' ' CYS . . . 71.15 -51.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -56.35 -45.64 80.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.54 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.799 ' N ' HD12 ' I' ' 122' ' ' LEU . 0.2 OUTLIER -89.36 -25.85 21.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.593 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 45.6 mttm -67.58 -44.54 77.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.593 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . 0.401 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -80.46 -73.98 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.572 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' I' ' 124' ' ' ALA . 6.6 mt -39.39 -49.0 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.559 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -139.0 70.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.592 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.593 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -78.18 -30.82 49.46 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 15.7 m -63.75 -39.6 94.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . 0.486 ' NZ ' ' OD1' ' C' ' 18' ' ' ASN . 7.7 ttpp -125.01 118.03 25.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.583 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -152.63 -68.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.576 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 tptm . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.578 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' MET . . . . . 0.429 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' ASP . . . . . 0.657 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' ASP . . . . . 0.657 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' TYR . . . . . 0.493 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' LYS . . . . . 0.728 ' O ' HG21 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' VAL . . . . . 0.728 HG21 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' GLU . . . . . 0.588 ' H ' ' CG2' ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.473 ' OE2' ' O ' ' I' ' 131' ' ' LYS . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' PHE . . . . . 0.743 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' VAL . . . . . 0.765 ' CG2' ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' ALA . . . . . 0.741 ' HB1' ' CG2' ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' CYS . . . . . 0.765 ' O ' ' CG2' ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' ILE . . . . . 0.541 ' O ' ' OG1' ' C' ' 71' ' ' THR . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' SER . . . . . 1.127 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' THR . . . . . 1.127 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' GLU . . . . . 0.743 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . 0.516 ' O ' HG22 ' C' ' 44' ' ' VAL . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 42' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 44' ' ' VAL . . . . . 0.662 HG21 ' N ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 45' ' ' MET . . . . . 0.662 ' N ' HG21 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 48' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 50' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 51' ' ' ASN . . . . . 0.517 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.1 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 52' ' ' PRO . . . . . 0.644 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 53' ' ' THR . . . . . 0.433 ' H ' ' HG1' ' C' ' 53' ' ' THR . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 58' ' ' GLN . . . . . 0.658 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 61' ' ' ILE . . . . . 0.686 HD12 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 62' ' ' ASP . . . . . 0.631 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 64' ' ' VAL . . . . . 0.598 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 70' ' ' GLY . . . . . 0.686 ' O ' HD12 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 71' ' ' THR . . . . . 0.665 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 72' ' ' VAL . . . . . 0.436 ' H ' HG13 ' C' ' 72' ' ' VAL . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 74' ' ' PHE . . . . . 0.875 ' CE2' ' CZ ' ' C' ' 24' ' ' PHE . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 76' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 78' ' ' LEU . . . . . 0.764 ' CD1' ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 79' ' ' VAL . . . . . 0.519 ' O ' HG21 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 80' ' ' MET . . . . . . . . . . . . . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 81' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 82' ' ' VAL . . . . . 0.519 HG21 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' I' I ' 116' ' ' MET . . . . . 0.494 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 4.8 ptt? -138.89 145.93 40.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.537 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.6 t -108.1 142.58 38.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.575 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 118' ' ' ALA . . . . . 0.402 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -41.51 -41.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 119' ' ' ASP . . . . . 0.571 ' CG ' ' HZ3' ' I' ' 123' ' ' LYS . 42.1 t0 -60.43 -50.01 75.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.581 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 121' ' ' MET . . . . . 0.541 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 122' ' ' LEU . . . . . 0.643 ' N ' HD13 ' I' ' 122' ' ' LEU . 1.5 mp -82.32 -29.87 30.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 123' ' ' LYS . . . . . 0.69 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 49.3 mttp -71.28 -39.6 71.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.85 -70.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 125' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' I' ' 121' ' ' MET . 10.1 mp -51.54 -46.98 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 126' ' ' LEU . . . . . 0.511 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 9.7 mp -105.29 30.41 5.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 127' ' ' GLY . . . . . 0.69 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -60.39 81.8 0.02 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 128' ' ' SER . . . . . 0.436 ' N ' ' O ' ' I' ' 126' ' ' LEU . 34.5 m -169.16 -120.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.33 . . . . 0.0 110.576 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -55.5 -37.34 67.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 45.02 58.13 4.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' I' I ' 131' ' ' LYS . . . . . 0.473 ' O ' ' OE2' ' C' ' 19' ' ' GLU . 20.4 tptm . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.431 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.81 ' O ' HG12 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 8' ' ' ALA . . . . . 0.629 ' HB3' HG21 ' C' ' 82' ' ' VAL . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.81 HG12 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.73 ' N ' HG13 ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 14' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 1.284 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.276 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 0.565 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 1.059 HD12 HD13 ' C' ' 41' ' ' LEU . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 1.059 HD13 HD12 ' C' ' 36' ' ' ILE . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.62 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.545 ' O ' ' N ' ' C' ' 48' ' ' LEU . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.571 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.571 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.484 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 53' ' ' THR . . . . . 0.643 ' O ' HD12 ' C' ' 57' ' ' LEU . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.932 HD23 ' SD ' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.932 ' SD ' HD23 ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.672 HD11 HG12 ' C' ' 36' ' ' ILE . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.453 ' N ' HG22 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.839 HG21 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.517 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.556 ' HB ' HG23 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.401 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.839 ' O ' HG21 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.701 HD22 HG23 ' C' ' 9' ' ' VAL . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.5 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' C' ' 8' ' ' ALA . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.816 0.341 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.453 ' HA ' HD12 ' I' ' 122' ' ' LEU . 1.6 mp . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.43 HG22 ' O ' ' C' ' 4' ' ' ILE . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.681 HG13 HD23 ' C' ' 78' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.443 ' N ' HG12 ' C' ' 9' ' ' VAL . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 14' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 23' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.298 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 0.441 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.935 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.935 ' H ' HD13 ' C' ' 36' ' ' ILE . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.927 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.826 ' H ' HD11 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.553 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.447 ' O ' ' OD1' ' C' ' 51' ' ' ASN . 5.1 t-20 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.49 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.907 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 58' ' ' GLN . . . . . 0.584 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.784 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.642 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.456 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.633 HG13 ' HB2' ' C' ' 76' ' ' GLU . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.633 ' HB2' HG13 ' C' ' 72' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.577 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.681 HD23 HG13 ' C' ' 9' ' ' VAL . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.551 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.673 ' O ' ' SD ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 85' ' ' MET . . . . . 0.464 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 86' ' ' LYS . . . . . 0.464 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.318 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' I' I ' 121' ' ' MET . . . . . 0.435 ' O ' ' HG2' ' I' ' 121' ' ' MET . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.448 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.0 mp . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.626 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 3' ' ' ASP . . . . . 0.626 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.429 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.443 ' O ' HD22 ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.976 HD23 ' O ' ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 16' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.0 mm-40 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' C' ' 16' ' ' GLN . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.284 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.95 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.95 ' H ' HD13 ' C' ' 36' ' ' ILE . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.91 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.812 ' N ' HD11 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.635 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.586 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.586 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.47 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.96 HG21 ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.96 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.768 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.78 ' O ' HD12 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.78 HD12 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.561 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.772 0.32 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.6 mp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.571 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 14' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.294 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.661 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.617 HD23 HD22 ' C' ' 57' ' ' LEU . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.59 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.632 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.584 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.63 HD13 ' HB ' ' C' ' 38' ' ' THR . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.517 ' SD ' HD21 ' C' ' 41' ' ' LEU . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.891 HG21 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 63' ' ' GLU . . . . . 0.465 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.706 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.891 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' C' ' 76' ' ' GLU . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.4 ' N ' HG12 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.659 ' O ' HD12 ' C' ' 78' ' ' LEU . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.706 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.406 ' O ' ' HB3' ' C' ' 80' ' ' MET . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.659 HD12 ' O ' ' C' ' 74' ' ' PHE . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.512 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.538 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.512 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 85' ' ' MET . . . . . 0.519 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 86' ' ' LYS . . . . . 0.519 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.779 0.323 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.4 mp . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.465 ' O ' HG23 ' C' ' 9' ' ' VAL . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 1.095 HG22 HD22 ' C' ' 78' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 17' ' ' LYS . . . . . 0.962 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.962 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 0.955 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 1.312 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.038 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 1.027 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 1.038 ' O ' HG23 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 1.121 ' CD1' ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.696 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.974 HG23 HD23 ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.584 ' O ' HG13 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 43' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.584 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.546 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.729 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.603 ' OE1' HD23 ' C' ' 48' ' ' LEU . 0.4 OUTLIER -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.546 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 54' ' ' PRO . . . . . 0.642 ' HA ' HG21 ' C' ' 38' ' ' THR . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.974 HD23 HG23 ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.456 ' N ' ' SD ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.902 HG21 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.531 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.902 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.818 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.463 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 1.095 HD22 HG22 ' C' ' 9' ' ' VAL . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.697 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.797 0.332 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' I' I ' 121' ' ' MET . . . . . 0.729 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.462 ' N ' ' CD1' ' I' ' 122' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 3' ' ' ASP . . . . . 0.563 ' O ' ' OD1' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.443 HG22 ' O ' ' C' ' 4' ' ' ILE . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.7 HG22 ' N ' ' C' ' 10' ' ' GLU . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.7 ' N ' HG22 ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 0.591 ' CE2' HD21 ' C' ' 41' ' ' LEU . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 0.643 HG12 ' O ' ' C' ' 35' ' ' CYS . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 0.643 ' O ' HG12 ' C' ' 28' ' ' VAL . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 1.152 HD13 ' O ' ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 37' ' ' SER . . . . . 1.117 ' O ' HG22 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 38' ' ' THR . . . . . 1.117 HG22 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.591 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.662 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.624 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.624 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD22 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 58' ' ' GLN . . . . . 0.854 ' O ' HG22 ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.477 ' N ' ' SD ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.854 HG22 ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.468 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.6 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.908 ' HB ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.422 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.504 ' O ' HG22 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.446 ' HE1' HH21 ' C' ' 83' ' ' ARG . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.596 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 87' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' I' I ' 121' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' I' ' 121' ' ' MET . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.2 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 3' ' ' ASP . . . . . 0.589 ' O ' ' OD1' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.439 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.778 ' O ' HG22 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.828 ' O ' HD23 ' C' ' 12' ' ' LEU . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.761 ' N ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.937 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 13' ' ' THR . . . . . 0.504 HG22 ' N ' ' C' ' 14' ' ' GLU . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 14' ' ' GLU . . . . . 0.504 ' N ' HG22 ' C' ' 13' ' ' THR . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 17' ' ' LYS . . . . . 0.578 ' HB2' HD13 ' C' ' 12' ' ' LEU . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 0.793 ' CE2' HD21 ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.193 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 1.163 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 34' ' ' GLY . . . . . 0.512 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 1.193 ' O ' HG23 ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.498 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.7 ' C ' HG23 ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.775 HG22 HD12 ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.793 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.723 HG22 ' SD ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.723 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.718 HD23 ' O ' ' C' ' 48' ' ' LEU . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 53' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' C' ' 57' ' ' LEU . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.814 HD13 ' O ' ' C' ' 57' ' ' LEU . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 58' ' ' GLN . . . . . 0.559 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.787 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.566 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 63' ' ' GLU . . . . . 0.63 ' HG3' HG13 ' C' ' 64' ' ' VAL . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.586 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.76 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.618 HG13 ' HB2' ' C' ' 76' ' ' GLU . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.527 ' O ' HD12 ' C' ' 78' ' ' LEU . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.527 HD12 ' O ' ' C' ' 74' ' ' PHE . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.553 ' O ' HG22 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.728 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.553 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' I' ' 122' ' ' LEU . 1.3 mp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' C' ' 4' ' ' ILE . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' C' ' 2' ' ' ASP . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.707 ' O ' HG13 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.795 ' O ' HG22 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.795 HG22 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.741 ' N ' HG23 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 0.591 ' O ' HG13 ' C' ' 28' ' ' VAL . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 0.614 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 0.731 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 29' ' ' LEU . . . . . 0.577 HD23 ' C ' ' C' ' 29' ' ' LEU . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 0.678 ' C ' HD13 ' C' ' 36' ' ' ILE . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 1.019 ' CG1' HG13 ' C' ' 72' ' ' VAL . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.615 ' C ' HG23 ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.615 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.505 ' N ' ' OG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 1.175 ' H ' ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.737 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.737 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.765 HD23 ' O ' ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.585 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 13.4 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.585 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 5.8 t-20 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.702 HD23 ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 59' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.442 ' N ' HG23 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 63' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 1.019 HG13 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.976 ' O ' HD23 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 75' ' ' ASP . . . . . 0.708 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.639 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 1.368 HD12 ' N ' ' C' ' 79' ' ' VAL . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 1.368 ' N ' HD12 ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.615 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.557 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.797 0.332 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' I' ' 122' ' ' LEU . 2.5 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.62 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 3' ' ' ASP . . . . . 0.62 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.631 ' O ' HG13 ' C' ' 9' ' ' VAL . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.797 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.815 ' O ' HD23 ' C' ' 12' ' ' LEU . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.763 ' N ' HG23 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.941 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 15' ' ' GLU . . . . . 0.408 ' O ' ' CD ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 17' ' ' LYS . . . . . 0.583 ' HB2' HD13 ' C' ' 12' ' ' LEU . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 0.614 ' O ' HG23 ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 0.827 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.548 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 37' ' ' SER . . . . . 0.909 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 38' ' ' THR . . . . . 0.912 ' OG1' HD13 ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.554 ' O ' HG22 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.554 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 51' ' ' ASN . . . . . 0.471 HD21 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.912 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.591 HG21 ' O ' ' C' ' 70' ' ' GLY . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 63' ' ' GLU . . . . . 0.658 ' HG3' HG22 ' C' ' 64' ' ' VAL . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.658 HG22 ' HG3' ' C' ' 63' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.578 ' C ' ' OD1' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.591 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.827 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.534 HG23 HG23 ' C' ' 61' ' ' ILE . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 73' ' ' ASP . . . . . 0.465 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.6 HD13 ' O ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.574 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.631 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 84' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.85 0.357 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' I' I ' 121' ' ' MET . . . . . 0.752 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.547 ' N ' ' CD1' ' I' ' 122' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 1' ' ' MET . . . . . 0.412 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 2' ' ' ASP . . . . . 0.625 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 3' ' ' ASP . . . . . 0.625 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 4' ' ' ILE . . . . . 0.452 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 5' ' ' TYR . . . . . 0.605 ' O ' HG13 ' C' ' 9' ' ' VAL . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 6' ' ' LYS . . . . . 0.774 ' O ' HG22 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 9' ' ' VAL . . . . . 0.774 HG22 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 10' ' ' GLU . . . . . 0.75 ' N ' HG23 ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 12' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 19' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 27' ' ' PHE . . . . . 0.749 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 28' ' ' VAL . . . . . 1.242 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 31' ' ' ALA . . . . . 1.187 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 34' ' ' GLY . . . . . 0.506 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 35' ' ' CYS . . . . . 1.242 ' O ' HG23 ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 36' ' ' ILE . . . . . 0.793 ' HB ' HG13 ' C' ' 72' ' ' VAL . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 37' ' ' SER . . . . . 1.132 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 38' ' ' THR . . . . . 1.132 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 40' ' ' GLU . . . . . 0.749 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.745 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 42' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 44' ' ' VAL . . . . . 0.705 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 45' ' ' MET . . . . . 0.705 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 48' ' ' LEU . . . . . 0.668 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 52' ' ' PRO . . . . . 0.655 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 58' ' ' GLN . . . . . 0.67 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 61' ' ' ILE . . . . . 0.873 HD13 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 62' ' ' ASP . . . . . 0.615 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 64' ' ' VAL . . . . . 0.593 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 70' ' ' GLY . . . . . 0.873 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 71' ' ' THR . . . . . 0.69 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 72' ' ' VAL . . . . . 0.793 HG13 ' HB ' ' C' ' 36' ' ' ILE . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 74' ' ' PHE . . . . . 0.914 ' O ' HD12 ' C' ' 78' ' ' LEU . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 76' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 78' ' ' LEU . . . . . 0.914 HD12 ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 79' ' ' VAL . . . . . 0.531 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 80' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 81' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 42.1 t0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.812 0.339 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' I' I ' 122' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' I' ' 122' ' ' LEU . 1.5 mp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.431 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.81 ' O ' HG12 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' ALA . . . . . 0.629 ' HB3' HG21 ' C' ' 82' ' ' VAL . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.81 HG12 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.73 ' N ' HG13 ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ASN . . . . . 0.421 HD21 ' HE2' ' I' ' 129' ' ' LYS . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 1.284 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.276 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 0.565 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 1.059 HD12 HD13 ' C' ' 41' ' ' LEU . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 1.059 HD13 HD12 ' C' ' 36' ' ' ILE . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.62 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.545 ' O ' ' N ' ' C' ' 48' ' ' LEU . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.576 ' OE1' ' NE ' ' I' ' 115' ' ' ARG . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.571 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.484 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 53' ' ' THR . . . . . 0.643 ' O ' HD12 ' C' ' 57' ' ' LEU . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.932 HD23 ' SD ' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.932 ' SD ' HD23 ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.672 HD11 HG12 ' C' ' 36' ' ' ILE . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.453 ' N ' HG22 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.839 HG21 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.517 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.556 ' HB ' HG23 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.401 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.839 ' O ' HG21 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.701 HD22 HG23 ' C' ' 9' ' ' VAL . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.5 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' C' ' 8' ' ' ALA . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' I' I ' 115' ' ' ARG . . . . . 0.576 ' NE ' ' OE1' ' C' ' 50' ' ' GLN . 51.5 ttt85 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.476 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 58.36 130.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.557 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -94.6 143.54 26.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.661 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -43.51 -35.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -57.73 -42.43 83.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.562 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.591 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.661 HD13 ' O ' ' I' ' 118' ' ' ALA . 1.6 mp -91.51 -21.45 20.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.645 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 91.3 mttt -82.56 -46.02 13.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.551 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 124' ' ' ALA . . . . . 0.516 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -80.47 -84.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.579 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.795 ' H ' HD12 ' I' ' 125' ' ' LEU . 8.1 mp -30.6 -51.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.593 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.623 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -135.34 70.71 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.577 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.645 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -72.92 -29.35 65.16 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 33.3 t -81.25 152.65 27.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.59 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 129' ' ' LYS . . . . . 0.421 ' HE2' HD21 ' C' ' 18' ' ' ASN . 38.1 tttp 56.8 34.25 24.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.581 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -129.64 134.05 47.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 50.7 mttm . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.592 -179.988 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.43 HG22 ' O ' ' C' ' 4' ' ' ILE . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.681 HG13 HD23 ' C' ' 78' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.443 ' N ' HG12 ' C' ' 9' ' ' VAL . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 14' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.298 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 0.441 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.935 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.935 ' H ' HD13 ' C' ' 36' ' ' ILE . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.927 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.826 ' H ' HD11 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.553 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.447 ' O ' ' OD1' ' C' ' 51' ' ' ASN . 5.1 t-20 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.49 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.907 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 58' ' ' GLN . . . . . 0.584 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.784 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.642 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.456 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.633 HG13 ' HB2' ' C' ' 76' ' ' GLU . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.633 ' HB2' HG13 ' C' ' 72' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.577 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.681 HD23 HG13 ' C' ' 9' ' ' VAL . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.551 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.673 ' O ' ' SD ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 84' ' ' CYS . . . . . 0.846 ' SG ' ' HB2' ' I' ' 118' ' ' ALA . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 85' ' ' MET . . . . . 0.464 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 86' ' ' LYS . . . . . 0.464 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 78.4 mtm-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.613 ' O ' ' SD ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -151.15 96.56 2.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 32.7 m -61.34 142.04 57.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.524 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.846 ' HB2' ' SG ' ' C' ' 84' ' ' CYS . . . -49.56 -32.6 12.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.582 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -58.33 -44.1 88.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.548 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.63 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.667 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.0 mp -86.83 -25.39 24.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.496 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 66.7 mttm -80.31 -46.3 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.512 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 124' ' ' ALA . . . . . 0.518 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -77.0 -84.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.557 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.711 ' H ' HD12 ' I' ' 125' ' ' LEU . 9.0 mp -29.81 -50.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.595 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.586 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.1 OUTLIER -133.37 79.24 1.82 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.557 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.703 ' O ' ' N ' ' I' ' 129' ' ' LYS . . . -80.14 -168.97 38.72 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 1.1 t 55.09 -67.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' I' I ' 129' ' ' LYS . . . . . 0.703 ' N ' ' O ' ' I' ' 127' ' ' GLY . 53.2 mttp -83.0 130.17 35.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.577 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 130' ' ' HIS . . . . . 0.657 ' CG ' ' H ' ' I' ' 131' ' ' LYS . 1.4 t-80 -165.38 -136.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' I' I ' 131' ' ' LYS . . . . . 0.657 ' H ' ' CG ' ' I' ' 130' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.592 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.626 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 3' ' ' ASP . . . . . 0.626 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.429 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.443 ' O ' HD22 ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.976 HD23 ' O ' ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 16' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' C' ' 19' ' ' GLU . 24.6 mm100 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.566 ' O ' HD21 ' I' ' 126' ' ' LEU . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.569 ' HB3' HD21 ' I' ' 126' ' ' LEU . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.284 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.95 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.95 ' H ' HD13 ' C' ' 36' ' ' ILE . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.91 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.812 ' N ' HD11 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.635 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.586 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.586 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.47 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.96 HG21 ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.96 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.768 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.78 ' O ' HD12 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.78 HD12 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.561 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 84' ' ' CYS . . . . . 0.571 ' SG ' ' NH2' ' I' ' 115' ' ' ARG . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 115' ' ' ARG . . . . . 0.571 ' NH2' ' SG ' ' C' ' 84' ' ' CYS . 67.2 ttt180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.65 ' O ' ' SD ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -89.9 113.84 25.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.533 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.9 t -73.41 138.17 45.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.598 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.621 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -44.74 -38.75 4.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -60.91 -44.39 97.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.648 ' CG ' HD22 ' I' ' 125' ' ' LEU . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.621 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.6 mp -77.31 -27.99 53.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.696 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 43.8 mtpt -72.96 -42.71 63.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.56 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -83.23 -74.85 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.549 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.648 HD22 ' CG ' ' I' ' 121' ' ' MET . 9.9 mp -42.7 -45.33 4.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.599 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.605 ' N ' HD12 ' I' ' 126' ' ' LEU . 9.5 mp -106.78 24.52 12.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.696 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -58.71 -33.19 71.59 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 21.9 t -63.46 -42.78 98.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.584 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' I' I ' 129' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' I' ' 126' ' ' LEU . 92.0 mttt -131.66 128.88 39.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -144.63 162.54 36.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' I' I ' 131' ' ' LYS . . . . . 0.467 ' NZ ' ' OE2' ' C' ' 19' ' ' GLU . 67.3 mttm . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.577 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.571 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.294 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.661 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.617 HD23 HD22 ' C' ' 57' ' ' LEU . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.59 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.632 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.584 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.63 HD13 ' HB ' ' C' ' 38' ' ' THR . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.517 ' SD ' HD21 ' C' ' 41' ' ' LEU . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.891 HG21 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 63' ' ' GLU . . . . . 0.642 ' CD ' HH22 ' I' ' 115' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.706 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.891 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' C' ' 76' ' ' GLU . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.4 ' N ' HG12 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.659 ' O ' HD12 ' C' ' 78' ' ' LEU . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.706 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.406 ' O ' ' HB3' ' C' ' 80' ' ' MET . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.659 HD12 ' O ' ' C' ' 74' ' ' PHE . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.512 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.538 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.512 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 84' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' I' ' 118' ' ' ALA . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 85' ' ' MET . . . . . 0.519 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 86' ' ' LYS . . . . . 0.519 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 115' ' ' ARG . . . . . 0.642 HH22 ' CD ' ' C' ' 63' ' ' GLU . 53.5 ttt85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.624 ' O ' ' SD ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -94.3 106.47 18.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.596 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -64.97 137.92 58.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.566 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.682 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -48.82 -32.31 8.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -66.93 -41.82 86.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.559 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.666 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.682 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.4 mp -82.7 -21.55 34.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 42.5 mttm -77.61 -45.47 25.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.517 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 124' ' ' ALA . . . . . 0.512 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -83.08 -80.42 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.559 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.694 ' H ' HD12 ' I' ' 125' ' ' LEU . 8.5 mp -31.2 -49.74 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.532 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.557 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -139.53 72.41 1.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.531 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.593 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -84.5 -27.94 34.34 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 26.1 t -71.54 -39.95 70.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.773 0.32 . . . . 0.0 110.572 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -85.87 -69.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 45.71 -141.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.588 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 62.9 tttt . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.602 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.465 ' O ' HG23 ' C' ' 9' ' ' VAL . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 1.095 HG22 HD22 ' C' ' 78' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' LYS . . . . . 0.962 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.962 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 0.955 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 1.312 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.038 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 1.027 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 1.038 ' O ' HG23 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 1.121 ' CD1' ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.696 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.974 HG23 HD23 ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.584 ' O ' HG13 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 43' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.584 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.546 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.729 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.603 ' OE1' HD23 ' C' ' 48' ' ' LEU . 0.4 OUTLIER -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.546 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 54' ' ' PRO . . . . . 0.642 ' HA ' HG21 ' C' ' 38' ' ' THR . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.974 HD23 HG23 ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.456 ' N ' ' SD ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.902 HG21 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.531 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.902 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.818 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.463 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 1.095 HD22 HG22 ' C' ' 9' ' ' VAL . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.697 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 84' ' ' CYS . . . . . 0.404 ' HB3' ' H ' ' I' ' 118' ' ' ALA . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 37.0 ptt-85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' C' ' 48' ' ' LEU . 5.5 ptt? -100.45 143.86 30.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.566 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 46.9 p -99.38 147.27 25.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.641 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.57 -41.85 15.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.551 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -60.04 -42.12 93.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.587 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.729 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.696 ' O ' ' C ' ' I' ' 126' ' ' LEU . 0.8 OUTLIER -87.52 -26.78 23.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.604 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 13.6 mtpp -68.47 -48.71 63.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 124' ' ' ALA . . . . . 0.659 ' HB3' HD12 ' C' ' 48' ' ' LEU . . . -75.01 -72.23 0.31 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.628 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 8.0 mt -42.48 -45.48 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.55 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.696 ' C ' ' O ' ' I' ' 122' ' ' LEU . 0.3 OUTLIER -155.79 77.97 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.54 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.604 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -104.84 1.95 41.62 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 91.4 p -81.26 -36.55 29.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.792 0.329 . . . . 0.0 110.587 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -109.04 -6.6 15.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.589 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' I' I ' 130' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' I' ' 126' ' ' LEU . 46.4 t60 -59.31 -41.68 89.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' I' I ' 131' ' ' LYS . . . . . 0.456 ' OXT' ' O ' ' I' ' 130' ' ' HIS . 18.8 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.554 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' ASP . . . . . 0.563 ' O ' ' OD1' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.443 HG22 ' O ' ' C' ' 4' ' ' ILE . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.7 HG22 ' N ' ' C' ' 10' ' ' GLU . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.7 ' N ' HG22 ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 0.591 ' CE2' HD21 ' C' ' 41' ' ' LEU . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 0.643 HG12 ' O ' ' C' ' 35' ' ' CYS . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 0.643 ' O ' HG12 ' C' ' 28' ' ' VAL . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 1.152 HD13 ' O ' ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 37' ' ' SER . . . . . 1.117 ' O ' HG22 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 38' ' ' THR . . . . . 1.117 HG22 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.591 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.662 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.624 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.624 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD22 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 58' ' ' GLN . . . . . 0.854 ' O ' HG22 ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.477 ' N ' ' SD ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.854 HG22 ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.468 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.6 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.908 ' HB ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.422 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.504 ' O ' HG22 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.446 ' HE1' HH21 ' C' ' 83' ' ' ARG . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.596 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 87' ' ' ASP . . . . . 0.424 ' O ' ' OD1' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.587 ' O ' ' SD ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -90.79 106.0 18.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.564 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 19.9 t -67.54 139.51 56.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.543 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.669 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -48.56 -31.64 6.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.536 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -63.69 -43.57 96.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.501 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.501 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.669 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.2 mp -85.24 -29.51 24.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.7 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 86.6 mttt -73.03 -41.75 63.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.83 -76.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.564 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.632 ' N ' HD12 ' I' ' 125' ' ' LEU . 9.5 mp -45.32 -47.11 13.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.593 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.592 ' N ' HD12 ' I' ' 126' ' ' LEU . 9.8 mp -106.0 35.0 3.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.7 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -62.83 -33.61 87.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 18.9 t -59.34 -42.55 91.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.333 . . . . 0.0 110.535 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.31 126.65 23.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.565 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -168.13 143.92 3.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.558 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.959 -1.019 . . . . 0.0 110.565 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 3' ' ' ASP . . . . . 0.589 ' O ' ' OD1' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.439 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.778 ' O ' HG22 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.828 ' O ' HD23 ' C' ' 12' ' ' LEU . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.761 ' N ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.937 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 13' ' ' THR . . . . . 0.504 HG22 ' N ' ' C' ' 14' ' ' GLU . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 14' ' ' GLU . . . . . 0.504 ' N ' HG22 ' C' ' 13' ' ' THR . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 17' ' ' LYS . . . . . 0.578 ' HB2' HD13 ' C' ' 12' ' ' LEU . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 0.793 ' CE2' HD21 ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.193 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 1.163 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 34' ' ' GLY . . . . . 0.512 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 1.193 ' O ' HG23 ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.498 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.7 ' C ' HG23 ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.775 HG22 HD12 ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.793 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.723 HG22 ' SD ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.723 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.718 HD23 ' O ' ' C' ' 48' ' ' LEU . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 53' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' C' ' 57' ' ' LEU . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.814 HD13 ' O ' ' C' ' 57' ' ' LEU . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 58' ' ' GLN . . . . . 0.559 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.787 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.566 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 63' ' ' GLU . . . . . 0.63 ' HG3' HG13 ' C' ' 64' ' ' VAL . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.586 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.76 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.618 HG13 ' HB2' ' C' ' 76' ' ' GLU . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.527 ' O ' HD12 ' C' ' 78' ' ' LEU . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.527 HD12 ' O ' ' C' ' 74' ' ' PHE . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.553 ' O ' HG22 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.728 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.553 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' I' I ' 115' ' ' ARG . . . . . 0.424 ' NH1' ' O ' ' I' ' 116' ' ' MET . 63.9 ttt-85 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.456 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 2.4 ptt? -102.46 147.02 27.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.543 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 25.6 m -114.82 146.86 40.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.568 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.649 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.13 -37.16 6.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.566 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -62.86 -44.7 95.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.582 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 126' ' ' LEU . 1.3 mp -79.9 -27.3 39.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.414 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 73.5 mttt -74.56 -49.47 21.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.573 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.26 -75.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.574 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.651 ' HB3' HD23 ' I' ' 126' ' ' LEU . 10.7 mp -41.17 -51.3 3.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -137.62 85.1 2.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.538 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.414 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -96.68 172.01 28.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 73.02 -52.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.786 0.326 . . . . 0.0 110.567 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -78.37 -2.41 38.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.566 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -114.48 136.7 52.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.556 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 57.5 mttp . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.506 -179.953 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' C' ' 4' ' ' ILE . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' C' ' 2' ' ' ASP . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.707 ' O ' HG13 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.795 ' O ' HG22 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.795 HG22 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.741 ' N ' HG23 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 0.591 ' O ' HG13 ' C' ' 28' ' ' VAL . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 0.614 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 0.731 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 29' ' ' LEU . . . . . 0.577 HD23 ' C ' ' C' ' 29' ' ' LEU . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 0.678 ' C ' HD13 ' C' ' 36' ' ' ILE . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 1.019 ' CG1' HG13 ' C' ' 72' ' ' VAL . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.615 ' C ' HG23 ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.615 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.505 ' N ' ' OG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 1.175 ' H ' ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.737 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.737 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.765 HD23 ' O ' ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.585 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 13.4 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.585 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 5.8 t-20 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.702 HD23 ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 59' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.442 ' N ' HG23 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 63' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 1.019 HG13 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.976 ' O ' HD23 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 75' ' ' ASP . . . . . 0.708 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.639 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 1.368 HD12 ' N ' ' C' ' 79' ' ' VAL . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 1.368 ' N ' HD12 ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.615 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.557 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.501 ' C ' ' SD ' ' I' ' 116' ' ' MET . 0.0 OUTLIER -98.44 137.56 36.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.527 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -109.34 145.79 35.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.605 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.651 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.24 -36.08 5.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -62.72 -43.16 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.532 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.651 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.5 mp -80.67 -33.49 35.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.769 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 9.7 mtmp? -75.01 -41.62 59.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.529 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.75 -69.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.57 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.631 ' N ' HD12 ' I' ' 125' ' ' LEU . 9.6 mp -57.62 -46.69 83.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.535 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 8.4 mt -107.8 41.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.561 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.769 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -64.67 -29.71 75.95 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 72.2 p -100.91 -29.76 12.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.756 0.312 . . . . 0.0 110.543 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -99.88 16.34 24.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -54.21 -40.31 67.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.604 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.62 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 3' ' ' ASP . . . . . 0.62 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.631 ' O ' HG13 ' C' ' 9' ' ' VAL . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.797 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.815 ' O ' HD23 ' C' ' 12' ' ' LEU . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.763 ' N ' HG23 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.941 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' GLU . . . . . 0.408 ' O ' ' CD ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' LYS . . . . . 0.583 ' HB2' HD13 ' C' ' 12' ' ' LEU . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ASN . . . . . 0.486 ' OD1' ' NZ ' ' I' ' 129' ' ' LYS . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 0.614 ' O ' HG23 ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 0.827 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.548 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 37' ' ' SER . . . . . 0.909 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 38' ' ' THR . . . . . 0.912 ' OG1' HD13 ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.554 ' O ' HG22 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.554 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 51' ' ' ASN . . . . . 0.471 HD21 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.912 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.591 HG21 ' O ' ' C' ' 70' ' ' GLY . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 63' ' ' GLU . . . . . 0.658 ' HG3' HG22 ' C' ' 64' ' ' VAL . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.658 HG22 ' HG3' ' C' ' 63' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.578 ' C ' ' OD1' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.591 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.827 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.534 HG23 HG23 ' C' ' 61' ' ' ILE . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 73' ' ' ASP . . . . . 0.465 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.6 HD13 ' O ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.574 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.631 ' N ' ' SD ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 84' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' I' I ' 115' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' I' ' 116' ' ' MET . 83.7 mtm-85 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.519 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 55.95 125.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.561 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' I' I ' 117' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' I' ' 118' ' ' ALA . 73.7 m -76.06 19.53 0.22 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.61 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.562 ' HB2' ' SG ' ' C' ' 84' ' ' CYS . . . 71.15 -51.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -56.35 -45.64 80.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.54 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.752 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.547 ' N ' ' CD1' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -89.36 -25.85 21.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.593 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 45.6 mttm -67.58 -44.54 77.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.593 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 124' ' ' ALA . . . . . 0.671 ' HB3' HD12 ' C' ' 48' ' ' LEU . . . -80.46 -73.98 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.572 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.407 ' N ' HD23 ' I' ' 125' ' ' LEU . 6.6 mt -39.39 -49.0 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.559 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -139.0 70.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.592 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.593 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -78.18 -30.82 49.46 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 15.7 m -63.75 -39.6 94.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' I' I ' 129' ' ' LYS . . . . . 0.486 ' NZ ' ' OD1' ' C' ' 18' ' ' ASN . 7.7 ttpp -125.01 118.03 25.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.583 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -152.63 -68.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.576 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 tptm . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.578 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 1' ' ' MET . . . . . 0.412 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 2' ' ' ASP . . . . . 0.625 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 3' ' ' ASP . . . . . 0.625 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 4' ' ' ILE . . . . . 0.452 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 5' ' ' TYR . . . . . 0.605 ' O ' HG13 ' C' ' 9' ' ' VAL . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 6' ' ' LYS . . . . . 0.774 ' O ' HG22 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' VAL . . . . . 0.774 HG22 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 10' ' ' GLU . . . . . 0.75 ' N ' HG23 ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 12' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.473 ' OE2' ' O ' ' I' ' 131' ' ' LYS . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 27' ' ' PHE . . . . . 0.749 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 28' ' ' VAL . . . . . 1.242 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 31' ' ' ALA . . . . . 1.187 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 34' ' ' GLY . . . . . 0.506 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 35' ' ' CYS . . . . . 1.242 ' O ' HG23 ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 36' ' ' ILE . . . . . 0.793 ' HB ' HG13 ' C' ' 72' ' ' VAL . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 37' ' ' SER . . . . . 1.132 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 38' ' ' THR . . . . . 1.132 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 40' ' ' GLU . . . . . 0.749 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.745 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 42' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 44' ' ' VAL . . . . . 0.705 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 45' ' ' MET . . . . . 0.705 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 48' ' ' LEU . . . . . 0.668 HD23 ' O ' ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 52' ' ' PRO . . . . . 0.655 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 58' ' ' GLN . . . . . 0.67 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 61' ' ' ILE . . . . . 0.873 HD13 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 62' ' ' ASP . . . . . 0.615 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 64' ' ' VAL . . . . . 0.593 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 70' ' ' GLY . . . . . 0.873 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 71' ' ' THR . . . . . 0.69 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 72' ' ' VAL . . . . . 0.793 HG13 ' HB ' ' C' ' 36' ' ' ILE . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 74' ' ' PHE . . . . . 0.914 ' O ' HD12 ' C' ' 78' ' ' LEU . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 76' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 78' ' ' LEU . . . . . 0.914 HD12 ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 79' ' ' VAL . . . . . 0.531 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 80' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 81' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' I' I ' 116' ' ' MET . . . . . 0.494 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 4.8 ptt? -138.89 145.93 40.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.537 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.6 t -108.1 142.58 38.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.575 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 118' ' ' ALA . . . . . 0.633 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -41.51 -41.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 119' ' ' ASP . . . . . 0.514 ' CG ' ' NZ ' ' I' ' 123' ' ' LYS . 42.1 t0 -60.43 -50.01 75.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.581 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 121' ' ' MET . . . . . 0.538 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 122' ' ' LEU . . . . . 0.633 HD13 ' O ' ' I' ' 118' ' ' ALA . 1.5 mp -82.32 -29.87 30.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 123' ' ' LYS . . . . . 0.69 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 49.3 mttp -71.28 -39.6 71.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.85 -70.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 125' ' ' LEU . . . . . 0.615 ' N ' HD12 ' I' ' 125' ' ' LEU . 10.1 mp -51.54 -46.98 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 126' ' ' LEU . . . . . 0.62 ' N ' HD12 ' I' ' 126' ' ' LEU . 9.7 mp -105.29 30.41 5.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 127' ' ' GLY . . . . . 0.69 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -60.39 81.8 0.02 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 128' ' ' SER . . . . . 0.436 ' N ' ' O ' ' I' ' 126' ' ' LEU . 34.5 m -169.16 -120.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.33 . . . . 0.0 110.576 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -55.5 -37.34 67.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 45.02 58.13 4.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' I' I ' 131' ' ' LYS . . . . . 0.473 ' O ' ' OE2' ' C' ' 19' ' ' GLU . 20.4 tptm . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.431 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.81 ' O ' HG12 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . 0.629 ' HB3' HG21 ' C' ' 82' ' ' VAL . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.81 HG12 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.73 ' N ' HG13 ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 1.284 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.276 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 0.565 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 1.059 HD12 HD13 ' C' ' 41' ' ' LEU . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 1.059 HD13 HD12 ' C' ' 36' ' ' ILE . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.62 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.545 ' O ' ' N ' ' C' ' 48' ' ' LEU . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.571 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.571 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.484 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . 0.643 ' O ' HD12 ' C' ' 57' ' ' LEU . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.932 HD23 ' SD ' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.932 ' SD ' HD23 ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.672 HD11 HG12 ' C' ' 36' ' ' ILE . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.453 ' N ' HG22 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.839 HG21 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.517 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.556 ' HB ' HG23 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.401 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.839 ' O ' HG21 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.701 HD22 HG23 ' C' ' 9' ' ' VAL . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.5 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' C' ' 8' ' ' ALA . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.816 0.341 . . . . 0.0 110.562 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.453 ' HA ' HD12 ' I' ' 122' ' ' LEU . 1.6 mp . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.43 HG22 ' O ' ' C' ' 4' ' ' ILE . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.681 HG13 HD23 ' C' ' 78' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.443 ' N ' HG12 ' C' ' 9' ' ' VAL . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.298 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 0.441 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.935 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.935 ' H ' HD13 ' C' ' 36' ' ' ILE . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.927 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.826 ' H ' HD11 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.553 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' C' ' 51' ' ' ASN . 2.9 t30 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.49 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.907 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . 0.584 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.784 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.642 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.456 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.633 HG13 ' HB2' ' C' ' 76' ' ' GLU . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.633 ' HB2' HG13 ' C' ' 72' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.577 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.681 HD23 HG13 ' C' ' 9' ' ' VAL . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.551 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.673 ' SD ' ' O ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . 0.464 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . 0.464 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.318 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . 0.435 ' O ' ' HG2' ' I' ' 121' ' ' MET . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.448 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.0 mp . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.626 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . 0.626 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.429 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.443 ' O ' HD22 ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.976 ' O ' HD23 ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.0 mm-40 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.432 ' N ' ' O ' ' C' ' 16' ' ' GLN . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.284 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.95 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.95 ' H ' HD13 ' C' ' 36' ' ' ILE . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.91 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.812 ' N ' HD11 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.635 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.586 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.586 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.47 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.96 HG21 ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.96 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.768 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.78 ' O ' HD12 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.78 HD12 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.561 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.772 0.32 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.6 mp . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.571 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.294 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.661 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.617 HD23 HD22 ' C' ' 57' ' ' LEU . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.59 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.632 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.584 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.63 HD13 ' HB ' ' C' ' 38' ' ' THR . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.517 ' SD ' HD21 ' C' ' 41' ' ' LEU . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.891 HG21 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . 0.465 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.706 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.891 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' C' ' 76' ' ' GLU . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.4 ' N ' HG12 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.659 ' O ' HD12 ' C' ' 78' ' ' LEU . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.706 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.406 ' O ' ' HB3' ' C' ' 80' ' ' MET . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.659 HD12 ' O ' ' C' ' 74' ' ' PHE . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.512 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.538 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.512 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . 0.519 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . 0.519 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.779 0.323 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.4 mp . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.465 ' O ' HG23 ' C' ' 9' ' ' VAL . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 1.095 HG22 HD22 ' C' ' 78' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . 0.962 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.962 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 0.955 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 1.312 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.038 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 1.027 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 1.038 ' O ' HG23 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 1.121 ' CD1' ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.696 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.974 HG23 HD23 ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.584 ' O ' HG13 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.584 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.546 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 1.021 HD23 HE21 ' C' ' 50' ' ' GLN . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 1.021 HE21 HD23 ' C' ' 48' ' ' LEU . 3.9 pt20 -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.452 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.2 OUTLIER -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.546 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . 0.642 ' HA ' HG21 ' C' ' 38' ' ' THR . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.974 HD23 HG23 ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.456 ' SD ' ' N ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.902 HG21 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.531 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.902 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.818 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.463 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 1.095 HD22 HG22 ' C' ' 9' ' ' VAL . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.797 0.332 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . 0.729 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.462 ' N ' ' CD1' ' I' ' 122' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . 0.563 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.443 HG22 ' O ' ' C' ' 4' ' ' ILE . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.7 HG22 ' N ' ' C' ' 10' ' ' GLU . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.7 ' N ' HG22 ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 0.591 ' CE2' HD21 ' C' ' 41' ' ' LEU . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 0.643 HG12 ' O ' ' C' ' 35' ' ' CYS . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 0.643 ' O ' HG12 ' C' ' 28' ' ' VAL . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 1.152 ' O ' HD13 ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 1.117 ' O ' HG22 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 1.117 HG22 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.591 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.662 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.624 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.624 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD22 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . 0.854 ' O ' HG22 ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.854 HG22 ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.468 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.6 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.908 ' HB ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.422 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.504 ' O ' HG22 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.446 ' HE1' HH21 ' C' ' 83' ' ' ARG . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.596 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' I' ' 121' ' ' MET . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' I' ' 122' ' ' LEU . 2.2 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.439 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.778 ' O ' HG22 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.828 ' O ' HD23 ' C' ' 12' ' ' LEU . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.761 ' N ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.937 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . 0.504 HG22 ' N ' ' C' ' 14' ' ' GLU . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . 0.504 ' N ' HG22 ' C' ' 13' ' ' THR . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . 0.578 ' HB2' HD13 ' C' ' 12' ' ' LEU . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 0.793 ' CE2' HD21 ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.193 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 1.163 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . 0.512 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 1.193 ' O ' HG23 ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.498 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.7 ' C ' HG23 ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.775 HG22 HD12 ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.793 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.723 HG22 ' SD ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.723 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.718 ' O ' HD23 ' C' ' 48' ' ' LEU . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' C' ' 57' ' ' LEU . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.814 HD13 ' O ' ' C' ' 57' ' ' LEU . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . 0.559 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.787 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.566 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . 0.63 ' HG3' HG13 ' C' ' 64' ' ' VAL . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.586 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.76 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.618 HG13 ' HB2' ' C' ' 76' ' ' GLU . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.527 ' O ' HD12 ' C' ' 78' ' ' LEU . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.527 HD12 ' O ' ' C' ' 74' ' ' PHE . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.553 ' O ' HG22 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.728 ' SD ' ' O ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.553 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' I' ' 122' ' ' LEU . 1.3 mp . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' C' ' 4' ' ' ILE . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' C' ' 2' ' ' ASP . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.707 ' O ' HG13 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.795 ' O ' HG22 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.795 HG22 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.741 ' N ' HG23 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 0.591 ' O ' HG13 ' C' ' 28' ' ' VAL . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 0.614 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 0.731 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . 0.577 HD23 ' C ' ' C' ' 29' ' ' LEU . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 0.678 ' C ' HD13 ' C' ' 36' ' ' ILE . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 1.019 ' CG1' HG13 ' C' ' 72' ' ' VAL . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.615 ' C ' HG23 ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.615 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.505 ' N ' ' OG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 1.175 ' H ' ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.737 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.737 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.765 ' O ' HD23 ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.585 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 2.5 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.585 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 4.2 t30 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.702 HD23 ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.442 ' N ' HG23 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 1.019 HG13 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.976 ' O ' HD23 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . 0.708 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.639 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 1.368 HD12 ' N ' ' C' ' 79' ' ' VAL . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 1.368 ' N ' HD12 ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.615 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.557 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.797 0.332 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' I' ' 122' ' ' LEU . 2.5 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.62 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . 0.62 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.631 ' O ' HG13 ' C' ' 9' ' ' VAL . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.797 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.815 ' O ' HD23 ' C' ' 12' ' ' LEU . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.763 ' N ' HG23 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.941 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . 0.408 ' CD ' ' O ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . 0.583 ' HB2' HD13 ' C' ' 12' ' ' LEU . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 0.614 ' O ' HG23 ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 0.827 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.548 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 0.909 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 0.912 ' OG1' HD13 ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.554 ' O ' HG22 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.554 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.471 HD21 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.912 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.591 HG21 ' O ' ' C' ' 70' ' ' GLY . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . 0.658 ' HG3' HG22 ' C' ' 64' ' ' VAL . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.658 HG22 ' HG3' ' C' ' 63' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.578 ' OD1' ' C ' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.591 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.827 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.534 HG23 HG23 ' C' ' 61' ' ' ILE . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . 0.465 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.6 HD13 ' O ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.574 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.631 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.85 0.357 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . 0.752 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.547 ' CD1' ' N ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . 0.412 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 2' ' ' ASP . . . . . 0.625 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 3' ' ' ASP . . . . . 0.625 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 4' ' ' ILE . . . . . 0.452 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 5' ' ' TYR . . . . . 0.605 ' O ' HG13 ' C' ' 9' ' ' VAL . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 6' ' ' LYS . . . . . 0.774 ' O ' HG22 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 9' ' ' VAL . . . . . 0.774 HG22 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 10' ' ' GLU . . . . . 0.75 ' N ' HG23 ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 12' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 19' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 27' ' ' PHE . . . . . 0.749 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 28' ' ' VAL . . . . . 1.242 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 31' ' ' ALA . . . . . 1.187 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 34' ' ' GLY . . . . . 0.506 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 35' ' ' CYS . . . . . 1.242 ' O ' HG23 ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 36' ' ' ILE . . . . . 0.793 ' HB ' HG13 ' C' ' 72' ' ' VAL . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 37' ' ' SER . . . . . 1.132 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 38' ' ' THR . . . . . 1.132 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 40' ' ' GLU . . . . . 0.749 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.745 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 42' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 44' ' ' VAL . . . . . 0.705 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 45' ' ' MET . . . . . 0.705 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 48' ' ' LEU . . . . . 0.668 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 51' ' ' ASN . . . . . 0.517 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.1 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 52' ' ' PRO . . . . . 0.655 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 58' ' ' GLN . . . . . 0.67 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 61' ' ' ILE . . . . . 0.873 HD13 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 62' ' ' ASP . . . . . 0.615 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 64' ' ' VAL . . . . . 0.593 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 70' ' ' GLY . . . . . 0.873 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 71' ' ' THR . . . . . 0.69 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 72' ' ' VAL . . . . . 0.793 HG13 ' HB ' ' C' ' 36' ' ' ILE . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 74' ' ' PHE . . . . . 0.914 ' O ' HD12 ' C' ' 78' ' ' LEU . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 76' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 78' ' ' LEU . . . . . 0.914 HD12 ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 79' ' ' VAL . . . . . 0.531 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 80' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 81' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 42.1 t0 . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.812 0.339 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' I' I ' 121' ' ' MET . . . . . . . . . . . . . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' I' I ' 122' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' I' ' 122' ' ' LEU . 1.5 mp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.561 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.561 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.4 m-20 -145.48 -163.34 1.7 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.533 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -122.37 89.46 3.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.431 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -77.97 -13.65 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.594 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.486 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 1.7 p90 -98.53 -51.12 4.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.574 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.81 ' O ' HG12 ' C' ' 9' ' ' VAL . 29.3 tttp -62.02 -27.49 68.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.99 -46.19 36.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.579 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . 0.629 ' HB3' HG21 ' C' ' 82' ' ' VAL . . . -57.75 -50.06 74.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.551 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.81 HG12 ' O ' ' C' ' 6' ' ' LYS . 11.9 p -45.86 -56.28 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.558 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.73 ' N ' HG13 ' C' ' 9' ' ' VAL . 84.2 tt0 -60.19 -29.96 69.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.557 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -93.39 44.83 1.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.585 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -109.14 139.59 43.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.513 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 18.7 p -99.72 159.41 15.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.9 mp0 -51.39 -20.58 1.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.573 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -67.67 -39.0 84.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.544 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -84.92 -58.12 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.565 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 tttp -43.86 -47.78 8.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.582 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . 0.421 HD21 ' HE2' ' I' ' 129' ' ' LYS . 63.6 t-20 -49.59 -32.38 12.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.536 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 91.9 mt-10 -79.02 -50.7 10.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.591 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.529 ' O ' ' CD1' ' C' ' 24' ' ' PHE . 11.0 m-30 -57.36 -44.39 84.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -52.11 -28.82 19.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.57 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -59.07 -64.57 0.89 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.59 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . 0.467 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -55.56 -52.4 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.558 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 1.095 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 2.3 m-30 -34.15 -49.27 0.35 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.573 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -65.09 -58.04 7.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.518 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 72.3 mt -59.66 -24.26 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 1.284 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -82.44 -2.34 52.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.572 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.276 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.4 OUTLIER -138.08 24.73 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 24.5 tp -68.55 93.59 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.541 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 118.13 2.49 15.93 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 0.565 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.75 169.79 4.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -96.67 -46.66 6.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.572 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -106.15 -44.46 4.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.81 47.0 0.05 OUTLIER Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 4.2 m -128.32 -167.88 1.83 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 1.059 HD12 HD13 ' C' ' 41' ' ' LEU . 0.1 OUTLIER -131.32 149.27 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.6 t -154.08 42.51 0.53 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.578 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.79 -57.42 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.578 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.468 ' N ' ' OG1' ' C' ' 38' ' ' THR . 41.9 mtpt -40.65 -38.7 0.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.569 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.426 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 50.5 mp0 -91.5 -47.24 7.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.592 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 1.059 HD13 HD12 ' C' ' 36' ' ' ILE . 3.7 tp -54.74 -61.9 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -41.39 -37.75 1.81 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -36.61 29.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.553 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.62 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.1 m -75.91 -39.23 37.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.545 ' O ' ' N ' ' C' ' 48' ' ' LEU . 12.5 mmt -44.92 -62.17 1.33 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 68.7 ttt-85 -39.0 -36.85 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.523 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttp -84.02 -30.97 25.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.581 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.545 ' N ' ' O ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -70.08 -7.9 45.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.55 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.6 18.95 24.14 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.576 ' OE1' ' NE ' ' I' ' 115' ' ' ARG . 8.1 tt0 -144.03 -168.09 2.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.736 0.303 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.571 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 1.9 t-20 -175.96 81.16 0.29 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.599 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.484 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.7 Cg_endo -73.49 155.16 50.52 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.095 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . 0.643 ' O ' HD12 ' C' ' 57' ' ' LEU . 0.2 OUTLIER -78.79 165.25 50.71 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.579 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.15 -21.01 24.25 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.779 2.319 . . . . 0.0 112.102 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.91 -30.52 35.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.58 ' O ' ' OE1' ' C' ' 59' ' ' GLU . 85.6 tt0 -92.28 -41.58 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.544 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.932 HD23 ' SD ' ' C' ' 60' ' ' MET . 1.7 mt -37.66 -42.73 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.543 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -41.85 -32.51 0.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.585 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . 0.58 ' OE1' ' O ' ' C' ' 56' ' ' GLU . 0.0 OUTLIER -53.99 -46.74 71.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.572 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.932 ' SD ' HD23 ' C' ' 57' ' ' LEU . 0.0 OUTLIER -63.56 -12.67 34.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.534 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.672 HD11 HG12 ' C' ' 36' ' ' ILE . 0.2 OUTLIER -104.65 -42.15 7.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.542 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.453 ' N ' HG22 ' C' ' 61' ' ' ILE . 21.3 t70 -71.19 -16.59 62.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.538 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -70.47 -17.06 62.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.57 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.839 HG21 ' O ' ' C' ' 76' ' ' GLU . 7.9 p -147.77 53.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.618 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.4 t0 -119.71 85.2 2.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.588 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -100.13 37.06 1.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.565 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.622 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 43.2 p30 -137.16 -24.36 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.622 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.24 15.07 80.88 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.924 -0.871 . . . . 0.0 110.924 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 24.3 p -79.05 -37.42 39.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.572 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.517 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.51 -36.43 4.39 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.7 p -95.74 153.65 17.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.538 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.556 ' HB ' HG23 ' C' ' 36' ' ' ILE . 2.0 t -97.63 152.16 4.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.581 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.401 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 89.2 m-20 -134.39 -176.6 4.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.559 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.562 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 51.2 p90 -58.16 -17.4 18.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.541 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -87.14 -44.71 11.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.839 ' O ' HG21 ' C' ' 64' ' ' VAL . 99.7 mt-10 -79.94 -46.28 17.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.589 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.625 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 4.7 t80 -55.4 -60.96 2.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.527 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.701 HD22 HG23 ' C' ' 9' ' ' VAL . 0.6 OUTLIER -34.66 -55.02 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.586 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.5 ' O ' HG12 ' C' ' 82' ' ' VAL . 2.7 t -56.73 -38.39 57.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.568 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.558 ' N ' ' O ' ' C' ' 77' ' ' PHE . 21.5 ttt -54.98 -17.45 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.1 mmt -91.33 -44.25 9.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.605 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.629 HG21 ' HB3' ' C' ' 8' ' ' ALA . 0.6 OUTLIER -59.77 -40.13 81.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.62 179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.501 ' N ' ' CG1' ' C' ' 82' ' ' VAL . 57.4 ttt85 -60.0 -31.26 69.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 74.6 m -109.38 40.95 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 30.5 ttp -57.9 -76.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.563 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -133.65 145.88 50.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -89.25 116.83 27.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.608 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -152.86 36.39 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.605 179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . 0.576 ' NE ' ' OE1' ' C' ' 50' ' ' GLN . 51.5 ttt85 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.476 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 58.36 130.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.557 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -94.6 143.54 26.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.661 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -43.51 -35.57 1.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -57.73 -42.43 83.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.562 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.22 38.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.591 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 25.8 ttp -63.03 -17.11 61.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.528 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.661 HD13 ' O ' ' I' ' 118' ' ' ALA . 1.6 mp -91.51 -21.45 20.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.555 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.645 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 91.3 mttt -82.56 -46.02 13.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.551 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . 0.516 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -80.47 -84.77 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.579 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.795 ' H ' HD12 ' I' ' 125' ' ' LEU . 8.1 mp -30.6 -51.56 0.15 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.593 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.623 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -135.34 70.71 1.43 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.577 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.645 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -72.92 -29.35 65.16 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 33.3 t -81.25 152.65 27.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.59 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . 0.421 ' HE2' HD21 ' C' ' 18' ' ' ASN . 38.1 tttp 56.8 34.25 24.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.581 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -129.64 134.05 47.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 50.7 mttm . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.592 -179.988 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.3 p30 -146.2 -163.39 1.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -122.33 89.52 3.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.542 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.43 HG22 ' O ' ' C' ' 4' ' ' ILE . 88.0 mt -77.94 -13.84 14.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.588 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.479 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 2.1 p90 -98.37 -51.29 4.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -61.68 -27.65 68.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.532 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -74.52 -47.67 31.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.61 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.44 -47.8 80.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.681 HG13 HD23 ' C' ' 78' ' ' LEU . 2.2 t -46.76 -56.07 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.547 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.443 ' N ' HG12 ' C' ' 9' ' ' VAL . 97.9 mt-10 -62.21 -28.31 69.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.57 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.89 45.43 1.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -111.14 139.61 46.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.534 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -98.98 160.38 14.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 53.8 mp0 -51.81 -21.11 2.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.601 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -66.12 -40.14 90.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.585 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . 0.451 ' O ' ' N ' ' C' ' 19' ' ' GLU . 87.6 mm-40 -84.31 -58.58 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.591 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -42.66 -47.46 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.582 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -50.84 -29.89 12.97 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.585 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' C' ' 16' ' ' GLN . 88.9 mt-10 -81.49 -49.35 10.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.54 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.451 ' CD2' ' CD1' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -59.75 -39.6 85.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 27.2 mmtp -57.45 -25.17 59.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.569 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.44 -67.41 0.43 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.553 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -52.7 -56.24 16.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.567 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 1.045 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 0.1 OUTLIER -36.43 -40.66 0.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.628 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -70.17 -47.68 60.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.571 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' C' ' 23' ' ' ALA . 92.9 mt -73.45 -19.99 18.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.597 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 1.322 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.54 -1.72 54.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.599 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.298 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -136.63 21.7 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.559 179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . 0.41 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 23.7 tp -65.82 95.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.94 2.05 18.92 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 0.441 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -64.8 169.5 5.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.805 0.336 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -96.38 -46.55 6.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -106.19 -44.69 4.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 140.65 47.78 0.05 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 3.9 m -129.25 -168.32 1.92 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.348 . . . . 0.0 110.554 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.935 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.17 152.42 37.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.935 ' H ' HD13 ' C' ' 36' ' ' ILE . 54.7 p -157.27 40.78 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.533 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.927 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 70.65 -55.05 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.576 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 27.3 mmtt -42.38 -38.41 1.85 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.41 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 73.8 mm-40 -93.07 -43.41 8.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.826 ' H ' HD11 ' C' ' 36' ' ' ILE . 15.7 tp -56.73 -60.06 4.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -43.49 -39.06 4.26 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -48.13 -37.68 16.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.842 0.353 . . . . 0.0 110.592 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.553 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -75.37 -39.37 41.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.555 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.532 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.8 mmt -45.17 -61.96 1.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.575 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.7 ttt85 -39.21 -36.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.521 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -84.51 -31.39 24.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.548 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' C' ' 45' ' ' MET . 46.0 tp -68.13 -11.97 60.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.551 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . 0.458 ' C ' ' OE1' ' C' ' 50' ' ' GLN . . . 103.17 18.35 15.27 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -145.32 -166.93 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.609 179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' C' ' 51' ' ' ASN . 2.9 t30 -175.7 81.94 0.3 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.601 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.49 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.42 156.17 50.36 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.792 2.328 . . . . 0.0 112.094 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.99 164.99 50.02 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.52 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.7 -18.84 24.85 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 C-N-CA 122.779 2.319 . . . . 0.0 112.076 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -82.67 -31.46 28.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.569 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -92.19 -41.64 10.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.519 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.907 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -37.64 -42.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.563 179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . 0.584 ' O ' HG13 ' C' ' 61' ' ' ILE . 95.7 mt-30 -41.04 -36.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.544 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -52.39 -42.31 63.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.583 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.05 -18.55 64.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.784 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.92 -38.52 5.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.574 179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.642 ' N ' HG13 ' C' ' 61' ' ' ILE . 87.9 m-20 -71.44 -13.47 61.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.604 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . 0.553 ' O ' ' NH1' ' C' ' 83' ' ' ARG . 27.3 mm-40 -74.13 -17.58 60.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.567 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 19.1 m -145.64 51.82 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.537 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 66.0 t0 -116.64 83.38 1.95 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -100.66 34.32 2.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.481 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 51.2 p30 -139.76 -8.85 1.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.577 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.412 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 57.9 52.8 50.05 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 52.0 p -114.74 -33.81 5.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.456 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 104.1 -33.52 6.51 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -99.35 153.92 18.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.571 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.633 HG13 ' HB2' ' C' ' 76' ' ' GLU . 54.4 t -100.35 152.12 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.557 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -134.67 179.71 6.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.542 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 44.4 p90 -54.94 -20.75 9.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.536 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -82.46 -47.77 11.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.557 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.633 ' HB2' HG13 ' C' ' 72' ' ' VAL . 98.1 mt-10 -77.55 -46.7 21.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.572 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.577 ' O ' ' N ' ' C' ' 80' ' ' MET . 41.7 t80 -52.73 -64.93 0.66 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.681 HD23 HG13 ' C' ' 9' ' ' VAL . 8.3 tp -31.78 -58.8 0.28 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.567 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.551 ' O ' HG22 ' C' ' 82' ' ' VAL . 53.7 t -51.86 -40.99 29.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.538 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.673 ' SD ' ' O ' ' C' ' 80' ' ' MET . 0.0 OUTLIER -53.26 -17.39 1.72 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.566 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . . . . . . . . . 37.5 mmt -91.43 -47.24 7.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.614 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.83 -39.41 70.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.553 ' NH1' ' O ' ' C' ' 63' ' ' GLU . 82.1 mtp180 -60.07 -32.23 70.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.598 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . 0.846 ' SG ' ' HB2' ' I' ' 118' ' ' ALA . 27.1 p -109.49 41.05 1.74 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.615 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . 0.464 ' SD ' ' NZ ' ' C' ' 86' ' ' LYS . 50.6 ttm -56.96 -75.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.57 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . 0.464 ' NZ ' ' SD ' ' C' ' 85' ' ' MET . 10.0 ptpp? -135.6 145.77 47.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.576 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -88.05 118.83 27.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -154.73 35.63 0.4 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.586 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.552 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 78.4 mtm-85 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.613 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -151.15 96.56 2.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 32.7 m -61.34 142.04 57.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.524 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.846 ' HB2' ' SG ' ' C' ' 84' ' ' CYS . . . -49.56 -32.6 12.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.582 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -58.33 -44.1 88.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.548 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -72.88 -52.5 14.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.63 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 34.0 ttp -56.96 -19.88 20.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.493 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.667 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.0 mp -86.83 -25.39 24.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.541 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.496 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 66.7 mttm -80.31 -46.3 16.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.512 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . 0.518 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -77.0 -84.2 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.557 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.711 ' H ' HD12 ' I' ' 125' ' ' LEU . 9.0 mp -29.81 -50.0 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.595 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.586 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.1 OUTLIER -133.37 79.24 1.82 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.557 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.703 ' O ' ' N ' ' I' ' 129' ' ' LYS . . . -80.14 -168.97 38.72 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 1.1 t 55.09 -67.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.321 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . 0.703 ' N ' ' O ' ' I' ' 127' ' ' GLY . 53.2 mttp -83.0 130.17 35.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.577 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . 0.657 ' CG ' ' H ' ' I' ' 131' ' ' LYS . 1.4 t-80 -165.38 -136.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . 0.657 ' H ' ' CG ' ' I' ' 130' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.592 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.626 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.0 t0 -146.26 -163.91 1.85 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.552 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . 0.626 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 77.6 m-20 -121.68 89.88 3.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.555 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.429 HG22 ' O ' ' C' ' 4' ' ' ILE . 86.8 mt -78.5 -13.71 13.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.575 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.574 ' CE2' ' NH2' ' C' ' 83' ' ' ARG . 11.6 m-85 -99.36 -49.38 4.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -26.44 68.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.511 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.5 -46.66 25.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.534 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.17 -48.91 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.443 ' O ' HD22 ' C' ' 12' ' ' LEU . 47.3 t -46.75 -55.53 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.576 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -61.39 -28.38 69.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 93.6 mm-40 -95.06 45.1 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.976 ' O ' HD23 ' C' ' 12' ' ' LEU . 0.4 OUTLIER -111.83 135.41 52.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 15.9 p -94.31 164.01 13.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.547 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -54.69 -21.91 12.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.605 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.92 -39.44 93.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.532 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . 0.437 HE22 ' NZ ' ' I' ' 131' ' ' LYS . 91.0 mm-40 -84.8 -58.81 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.614 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -43.1 -47.76 6.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.552 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -50.05 -30.24 10.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.533 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.566 ' O ' HD21 ' I' ' 126' ' ' LEU . 91.2 mt-10 -80.88 -49.74 10.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.567 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.625 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.2 -44.68 88.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.625 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 63.0 tttm -52.44 -26.82 13.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.606 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.569 ' HB3' HD21 ' I' ' 126' ' ' LEU . . . -61.55 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.596 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.61 -54.03 46.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.594 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 1.005 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 15.9 t80 -38.49 -38.51 0.39 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -72.21 -47.46 50.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . 0.4 ' N ' ' O ' ' C' ' 23' ' ' ALA . 76.2 mt -73.44 -19.59 18.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.595 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 1.334 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -83.01 -2.82 56.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.619 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.284 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -135.9 21.97 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.576 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 23.9 tp -65.74 94.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.59 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.27 2.52 17.95 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' C' ' 28' ' ' VAL . . . -65.11 169.49 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.794 0.33 . . . . 0.0 110.554 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -96.42 -46.36 6.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.521 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.7 p-10 -106.03 -45.79 4.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.522 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . 0.524 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 142.01 46.76 0.05 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . . . . . . . . . 31.6 p -128.7 -168.17 1.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.528 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.95 HD13 ' H ' ' C' ' 37' ' ' SER . 0.4 OUTLIER -129.64 152.77 37.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.598 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.95 ' H ' HD13 ' C' ' 36' ' ' ILE . 19.8 t -157.24 42.25 0.33 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.56 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.91 HG22 ' O ' ' C' ' 37' ' ' SER . 0.6 OUTLIER 69.88 -55.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.583 179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.749 ' N ' ' CG2' ' C' ' 38' ' ' THR . 53.1 tttt -42.4 -38.39 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.441 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 49.1 mp0 -94.48 -40.42 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.616 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.812 ' N ' HD11 ' C' ' 36' ' ' ILE . 0.4 OUTLIER -58.17 -59.5 5.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.526 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.35 -39.76 7.55 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -45.76 -38.6 7.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.835 0.35 . . . . 0.0 110.582 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 41' ' ' LEU . 1.0 OUTLIER -75.06 -40.08 44.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.577 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 22.3 mmt -44.11 -62.33 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.597 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.488 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 90.2 mtt180 -39.16 -37.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.553 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 45.1 ttp -83.69 -30.46 26.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.635 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.8 OUTLIER -70.0 -9.67 55.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.575 -179.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.39 18.86 20.2 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.586 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 6.8 tt0 -143.42 -165.47 2.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.586 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.2 OUTLIER -178.1 80.42 0.23 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.593 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.47 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.6 Cg_endo -73.4 155.88 50.6 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 C-N-CA 122.787 2.325 . . . . 0.0 112.125 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.86 164.73 51.63 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.5 -19.24 25.12 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.855 2.37 . . . . 0.0 112.08 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -83.03 -29.95 28.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' C' ' 57' ' ' LEU . 84.2 tt0 -93.62 -40.25 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.895 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.9 OUTLIER -39.58 -41.6 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.561 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -41.31 -34.92 0.56 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.558 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -52.88 -44.49 66.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 66.8 mmm -62.91 -15.72 56.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.538 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.96 HG21 ' O ' ' C' ' 70' ' ' GLY . 91.0 mt -103.51 -43.46 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.569 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -67.7 -14.48 62.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -72.57 -17.8 61.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.607 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.7 m -146.24 50.95 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.594 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.6 t0 -116.37 84.21 2.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.552 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.3 mm-40 -100.02 33.84 2.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.545 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.607 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 47.7 p30 -134.8 -23.31 1.58 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.569 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.588 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 77.81 20.13 74.2 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 43.6 p -84.15 -38.19 20.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.803 0.335 . . . . 0.0 110.572 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.96 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 107.6 -33.96 5.98 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 1.6 p -98.53 151.24 20.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.816 0.341 . . . . 0.0 110.579 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.768 HG22 ' HB ' ' C' ' 36' ' ' ILE . 1.8 m -94.11 155.38 3.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.567 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 89.7 m-20 -138.84 177.57 7.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.567 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.78 ' O ' HD12 ' C' ' 78' ' ' LEU . 27.6 p90 -52.35 -14.66 0.49 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . 0.461 ' OD1' ' CE2' ' C' ' 74' ' ' PHE . 93.1 m-20 -88.78 -49.91 6.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.865 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 95.4 mt-10 -77.48 -45.61 25.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -53.19 -55.58 23.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.565 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.78 HD12 ' O ' ' C' ' 74' ' ' PHE . 5.9 mt -41.07 -60.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.556 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.865 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.4 p -51.17 -39.18 20.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.573 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.401 ' O ' ' SD ' ' C' ' 80' ' ' MET . 1.2 tmm? -52.33 -20.51 2.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.559 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.561 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.75 -45.52 9.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.589 -179.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 36.4 t -57.59 -41.77 79.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.576 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.574 ' NH2' ' CE2' ' C' ' 5' ' ' TYR . 21.3 mmt180 -58.7 -30.83 67.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . 0.571 ' SG ' ' NH2' ' I' ' 115' ' ' ARG . 50.6 m -110.58 42.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 1.3 mtt -59.05 -75.21 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.577 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -136.51 145.14 44.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.576 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -87.06 119.13 26.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.548 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.41 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 56.0 p30 -154.63 34.49 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.519 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.574 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . 0.571 ' NH2' ' SG ' ' C' ' 84' ' ' CYS . 67.2 ttt180 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.65 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -89.9 113.84 25.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.533 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.9 t -73.41 138.17 45.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.598 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.621 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -44.74 -38.75 4.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -60.91 -44.39 97.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.5 -54.45 39.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.648 ' CG ' HD22 ' I' ' 125' ' ' LEU . 36.1 ttp -56.98 -28.53 62.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.621 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.6 mp -77.31 -27.99 53.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.563 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.696 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 43.8 mtpt -72.96 -42.71 63.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.56 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -83.23 -74.85 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.549 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.648 HD22 ' CG ' ' I' ' 121' ' ' MET . 9.9 mp -42.7 -45.33 4.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.599 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.605 HD12 ' N ' ' I' ' 126' ' ' LEU . 9.5 mp -106.78 24.52 12.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.568 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.696 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -58.71 -33.19 71.59 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 21.9 t -63.46 -42.78 98.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.584 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' I' ' 126' ' ' LEU . 92.0 mttt -131.66 128.88 39.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -144.63 162.54 36.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . 0.526 ' NZ ' ' OE2' ' C' ' 19' ' ' GLU . 67.3 mttm . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.577 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.589 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.5 mtt . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 1' ' ' MET . 77.4 m-20 -146.45 -164.75 2.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -120.63 90.5 3.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.561 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 tt -79.33 -13.13 13.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.584 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -99.46 -49.07 4.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.547 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 36.9 tttp -64.13 -26.5 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.589 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . 0.557 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -76.04 -46.31 29.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.521 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.44 -46.36 86.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.578 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.571 ' O ' ' HB2' ' C' ' 12' ' ' LEU . 55.1 t -47.98 -57.93 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.529 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.557 ' CG ' ' O ' ' C' ' 7' ' ' ALA . 18.8 pt-20 -60.74 -26.85 67.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.571 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -94.39 43.17 1.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.547 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.2 OUTLIER -108.61 141.4 40.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.534 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 19.8 p -100.95 159.38 15.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.536 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' C' ' 14' ' ' GLU . 56.1 mp0 -51.32 -20.18 1.59 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.566 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -68.01 -39.04 83.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.567 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -84.91 -58.53 2.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 53.6 tttp -43.52 -47.41 7.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.578 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . 0.679 HD21 ' NZ ' ' I' ' 129' ' ' LYS . 46.7 t30 -50.31 -29.21 9.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.1 mt-10 -81.98 -49.4 10.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.519 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -58.7 -43.59 90.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.587 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.624 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 20.8 tttt -53.5 -26.65 21.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -61.72 -67.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.548 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' C' ' 27' ' ' PHE . . . -54.5 -54.11 45.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.592 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 0.99 ' O ' ' CG1' ' C' ' 28' ' ' VAL . 17.7 t80 -38.3 -38.42 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.594 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -72.28 -47.92 46.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.21 -19.26 18.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 1.363 ' HD1' ' C ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -84.01 -0.68 52.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.587 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.294 HG12 ' CD1' ' C' ' 27' ' ' PHE . 0.7 OUTLIER -138.55 23.51 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.569 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.88 95.38 0.37 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.567 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.86 1.06 19.58 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.97 168.93 3.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.776 0.322 . . . . 0.0 110.614 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -96.0 -45.92 6.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.558 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -107.05 -44.25 4.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.588 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 139.93 48.2 0.06 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 0.431 ' O ' ' HE1' ' C' ' 27' ' ' PHE . 4.6 m -129.78 -168.35 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.815 0.34 . . . . 0.0 110.548 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.661 HG13 ' O ' ' C' ' 27' ' ' PHE . 3.0 tt -127.9 154.08 38.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.563 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.652 ' C ' HG23 ' C' ' 38' ' ' THR . 29.2 p -159.68 40.53 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.573 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.652 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 70.75 -57.0 0.6 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.602 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.462 ' N ' ' OG1' ' C' ' 38' ' ' THR . 34.9 ttmt -41.12 -37.65 0.92 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.565 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.433 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 47.7 mp0 -94.4 -43.31 8.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.599 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.617 HD23 HD22 ' C' ' 57' ' ' LEU . 17.5 tp -56.58 -59.03 5.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.559 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.17 -40.77 7.68 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -45.59 -38.12 6.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 0.0 110.573 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.59 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.97 -40.49 45.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.555 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.55 ' O ' ' N ' ' C' ' 48' ' ' LEU . 17.3 mmt -43.83 -62.63 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 83.1 mtp180 -38.42 -38.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.543 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 18.9 ttp -82.79 -31.41 28.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.632 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.8 OUTLIER -68.41 -10.57 56.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.53 17.85 20.46 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.502 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 0.0 OUTLIER -143.93 -166.38 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.602 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -176.4 81.88 0.27 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.584 ' HG2' HD21 ' C' ' 57' ' ' LEU . 53.2 Cg_endo -73.31 156.96 50.42 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 C-N-CA 122.827 2.351 . . . . 0.0 112.17 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.0 164.88 48.46 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.553 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -72.57 -18.4 25.7 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.817 2.345 . . . . 0.0 112.092 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.33 -31.49 26.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.1 mt-10 -92.06 -41.62 10.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.558 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.63 HD13 ' HB ' ' C' ' 38' ' ' THR . 7.9 mt -37.37 -42.18 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.567 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -41.22 -36.18 0.72 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -52.06 -44.76 64.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.517 ' SD ' HD21 ' C' ' 41' ' ' LEU . 14.4 mtt -62.55 -16.25 55.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.524 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.891 HG21 ' O ' ' C' ' 70' ' ' GLY . 4.0 mp -103.84 -40.74 6.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.544 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -69.19 -16.62 63.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.597 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . 0.642 ' CD ' HH22 ' I' ' 115' ' ' ARG . 81.9 tt0 -69.84 -20.75 63.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.584 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.706 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.3 m -146.91 58.99 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.572 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' C' ' 67' ' ' ASP . 54.4 t0 -123.08 67.88 0.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -71.54 14.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.603 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.992 ' O ' ' N ' ' C' ' 69' ' ' SER . 8.0 p30 -143.32 97.28 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.572 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . -37.63 64.28 0.0 OUTLIER Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.992 ' N ' ' O ' ' C' ' 67' ' ' ASP . 9.9 p -112.01 -42.75 3.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.833 0.349 . . . . 0.0 110.587 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.891 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 103.5 -35.84 4.75 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 3.0 p -97.89 153.67 18.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 110.539 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.658 HG13 ' HB2' ' C' ' 76' ' ' GLU . 38.6 t -98.47 153.81 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.585 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.4 ' N ' HG12 ' C' ' 72' ' ' VAL . 88.4 m-20 -137.02 177.97 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.552 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.659 ' O ' HD12 ' C' ' 78' ' ' LEU . 49.3 p90 -53.06 -20.11 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.552 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.15 -49.14 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.706 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 98.2 mt-10 -79.07 -44.37 22.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.558 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.406 ' O ' ' HB3' ' C' ' 80' ' ' MET . 25.3 t80 -53.1 -57.31 10.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.659 HD12 ' O ' ' C' ' 74' ' ' PHE . 6.1 mt -40.78 -61.08 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.523 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.512 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.4 t -48.16 -44.53 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.557 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 21.3 ttt -49.66 -18.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.527 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.538 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.0 OUTLIER -90.97 -47.63 7.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.589 179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.512 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -57.91 -38.45 66.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.476 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 45.3 mtp180 -60.98 -31.73 71.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . 0.46 ' O ' ' HB3' ' I' ' 118' ' ' ALA . 91.8 m -109.97 42.61 1.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.595 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . 0.519 ' CG ' ' H ' ' C' ' 86' ' ' LYS . 0.0 OUTLIER -58.79 -76.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.586 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . 0.519 ' H ' ' CG ' ' C' ' 85' ' ' MET . 50.2 mmtt -134.89 145.08 47.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . 0.514 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 79.4 m-20 -87.75 118.51 27.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.55 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.514 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 73.0 m-20 -154.45 35.75 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.628 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.552 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . 0.642 HH22 ' CD ' ' C' ' 63' ' ' GLU . 53.5 ttt85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.624 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.1 OUTLIER -94.3 106.47 18.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.596 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 18.7 t -64.97 137.92 58.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.566 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.682 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -48.82 -32.31 8.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -66.93 -41.82 86.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.559 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.04 -52.32 36.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.56 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.666 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 44.5 ttp -54.05 -23.84 15.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.531 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.682 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.4 mp -82.7 -21.55 34.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.533 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 42.5 mttm -77.61 -45.47 25.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.517 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . 0.512 ' O ' ' C ' ' I' ' 125' ' ' LEU . . . -83.08 -80.42 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.559 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.694 ' H ' HD12 ' I' ' 125' ' ' LEU . 8.5 mp -31.2 -49.74 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.532 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.557 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -139.53 72.41 1.4 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.531 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.593 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -84.5 -27.94 34.34 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.999 -0.84 . . . . 0.0 110.999 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 26.1 t -71.54 -39.95 70.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.773 0.32 . . . . 0.0 110.572 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . 0.679 ' NZ ' HD21 ' C' ' 18' ' ' ASN . 13.5 tptm -85.87 -69.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 45.71 -141.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.588 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 62.9 tttt . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.602 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.567 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 64.8 mtt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.3 m-20 -145.74 -163.98 1.85 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.554 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -121.53 89.08 3.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.587 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.2 tt -77.85 -14.31 14.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.596 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.465 ' O ' HG23 ' C' ' 9' ' ' VAL . 7.3 m-85 -98.11 -49.79 4.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.526 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -63.19 -27.94 69.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.588 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.94 28.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.8 -46.42 81.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.55 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 1.095 HG22 HD22 ' C' ' 78' ' ' LEU . 72.4 t -47.71 -54.52 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.602 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -64.2 -27.48 69.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.559 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -94.28 45.09 1.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.576 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -110.36 139.26 45.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.532 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -98.88 160.68 14.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.555 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -52.25 -21.14 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -67.57 -36.64 81.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.529 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -85.65 -59.46 2.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.559 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . 0.962 ' O ' ' HD1' ' C' ' 20' ' ' PHE . 90.0 mttt -42.64 -51.35 5.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.535 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -47.55 -24.6 0.9 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -89.85 -43.05 10.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.562 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.962 ' HD1' ' O ' ' C' ' 17' ' ' LYS . 0.0 OUTLIER -69.69 -21.6 63.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.593 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.874 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 37.8 tttt -75.85 -22.64 56.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.559 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.3 -63.56 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.59 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.73 -51.01 66.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.563 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 0.955 ' HA ' ' CD2' ' C' ' 27' ' ' PHE . 1.6 m-30 -42.65 -37.94 1.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.556 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -71.96 -47.12 54.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.584 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.8 mt -71.91 -26.66 25.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 1.312 ' HD1' ' O ' ' C' ' 27' ' ' PHE . 0.0 OUTLIER -78.61 -0.78 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.63 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.038 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -134.43 20.7 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . 0.547 ' O ' ' OE1' ' C' ' 40' ' ' GLU . 3.2 tt -66.62 97.72 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.534 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.12 3.83 24.34 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 1.027 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -66.48 166.58 12.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 0.0 110.525 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -94.27 -47.49 6.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.546 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . 0.52 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 30.9 p-10 -105.79 -45.39 4.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.568 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . 0.52 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 141.51 49.05 0.05 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 1.038 ' O ' HG23 ' C' ' 28' ' ' VAL . 30.1 p -132.86 -171.27 2.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.765 0.317 . . . . 0.0 110.565 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 1.121 ' CD1' ' O ' ' C' ' 27' ' ' PHE . 3.2 tp -122.53 160.43 24.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.589 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.696 ' O ' ' HB ' ' C' ' 38' ' ' THR . 8.4 t -164.01 34.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.974 HG23 HD23 ' C' ' 57' ' ' LEU . 1.9 m 74.64 -52.54 0.68 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.554 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 tptp -45.64 -38.34 6.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.502 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.547 ' OE1' ' O ' ' C' ' 29' ' ' LEU . 72.1 mm-40 -93.63 -42.6 9.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.584 ' O ' HG13 ' C' ' 44' ' ' VAL . 12.7 tp -56.34 -59.37 5.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.598 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . . . . . . . . . . . -44.84 -42.43 7.78 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.956 -0.858 . . . . 0.0 110.956 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' C' ' 40' ' ' GLU . 27.6 mmtp -44.07 -39.2 4.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.816 0.341 . . . . 0.0 110.553 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.584 HG13 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.02 -40.66 52.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.546 ' HG3' ' CG ' ' C' ' 52' ' ' PRO . 20.9 mmt -44.3 -62.19 1.25 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 33.1 mmm-85 -38.57 -38.01 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.539 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.5 ttt -82.66 -32.31 28.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.564 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 1.021 HD23 HE21 ' C' ' 50' ' ' GLN . 3.8 tp -67.13 -11.67 57.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.43 18.52 16.33 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 1.021 HE21 HD23 ' C' ' 48' ' ' LEU . 3.9 pt20 -143.83 -164.65 1.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 110.559 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.452 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.2 OUTLIER -177.8 81.43 0.24 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.548 -179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.546 ' CG ' ' HG3' ' C' ' 45' ' ' MET . 53.4 Cg_endo -73.38 155.35 50.97 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.837 2.358 . . . . 0.0 112.128 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.48 164.99 51.13 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.561 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . 0.642 ' HA ' HG21 ' C' ' 38' ' ' THR . 46.6 Cg_endo -72.16 -20.55 24.76 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.752 2.302 . . . . 0.0 112.129 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -81.79 -29.59 32.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.533 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.438 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -93.39 -42.39 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.585 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.974 HD23 HG23 ' C' ' 38' ' ' THR . 0.3 OUTLIER -37.21 -40.68 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.571 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 44.9 tp60 -43.39 -36.45 1.93 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.564 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -51.63 -41.81 61.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.54 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.456 ' SD ' ' N ' ' C' ' 60' ' ' MET . 1.1 mpt? -65.28 -16.56 63.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.902 HG21 ' O ' ' C' ' 70' ' ' GLY . 83.4 mt -102.74 -43.78 9.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -67.0 -13.65 62.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.607 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -73.91 -16.86 61.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.523 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.531 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 29.9 m -146.53 51.38 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.561 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.473 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 64.5 t0 -117.28 84.29 2.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.554 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -96.8 28.04 3.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.546 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.478 ' OD1' ' N ' ' C' ' 67' ' ' ASP . 0.0 OUTLIER -132.75 -31.23 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.63 ' O ' ' C ' ' C' ' 69' ' ' SER . . . 101.56 -45.42 1.39 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.63 ' C ' ' O ' ' C' ' 68' ' ' GLY . 0.0 OUTLIER -17.82 -56.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.8 0.333 . . . . 0.0 110.601 179.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.902 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 119.47 -28.99 6.29 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.457 ' HB ' ' O ' ' C' ' 36' ' ' ILE . 2.7 p -94.25 163.42 13.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.818 ' H ' HG22 ' C' ' 36' ' ' ILE . 0.5 OUTLIER -103.51 153.72 5.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.581 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -138.41 -177.35 4.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.557 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.463 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 70.6 m-85 -59.28 -14.19 10.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.542 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -90.79 -46.76 8.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.543 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.975 ' O ' ' CG1' ' C' ' 79' ' ' VAL . 53.6 mt-10 -76.57 -50.21 14.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.534 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.69 ' CD1' ' CE1' ' C' ' 24' ' ' PHE . 2.1 t80 -52.59 -61.23 2.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 1.095 HD22 HG22 ' C' ' 9' ' ' VAL . 4.0 tt -33.57 -58.35 0.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.975 ' CG1' ' O ' ' C' ' 76' ' ' GLU . 1.5 p -54.78 -36.92 38.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.59 ' N ' ' O ' ' C' ' 77' ' ' PHE . 9.6 tpt -54.75 -20.74 9.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.599 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -88.6 -44.67 10.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.524 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.64 -41.3 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 17.8 mmm180 -59.16 -30.79 68.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.576 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . 0.404 ' HB3' ' H ' ' I' ' 118' ' ' ALA . 92.7 m -110.36 41.37 1.77 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.527 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.24 -76.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.527 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -133.56 145.62 50.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.586 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . 0.485 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 80.9 m-20 -88.95 116.87 27.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.539 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.485 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 72.7 m-20 -153.24 36.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.562 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.568 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 37.0 ptt-85 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.409 ' SD ' ' CD2' ' C' ' 48' ' ' LEU . 5.5 ptt? -100.45 143.86 30.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.566 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 46.9 p -99.38 147.27 25.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.589 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.641 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.57 -41.85 15.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.551 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -60.04 -42.12 93.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.587 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.65 -44.53 64.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.512 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.729 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.8 ttp -62.67 -20.81 65.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.529 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.696 ' O ' ' C ' ' I' ' 126' ' ' LEU . 0.8 OUTLIER -87.52 -26.78 23.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.514 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.604 ' O ' ' HA3' ' I' ' 127' ' ' GLY . 13.6 mtpp -68.47 -48.71 63.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . 0.659 ' HB3' HD12 ' C' ' 48' ' ' LEU . . . -75.01 -72.23 0.31 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.628 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . . . . . . . . . 8.0 mt -42.48 -45.48 4.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.55 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.696 ' C ' ' O ' ' I' ' 122' ' ' LEU . 0.3 OUTLIER -155.79 77.97 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.54 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.604 ' HA3' ' O ' ' I' ' 123' ' ' LYS . . . -104.84 1.95 41.62 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.929 -0.869 . . . . 0.0 110.929 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 91.4 p -81.26 -36.55 29.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.792 0.329 . . . . 0.0 110.587 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -109.04 -6.6 15.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.589 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' I' ' 126' ' ' LEU . 46.4 t60 -59.31 -41.68 89.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . 0.456 ' OXT' ' O ' ' I' ' 130' ' ' HIS . 18.8 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.554 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.2 mtp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -146.55 -163.26 1.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . 0.563 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 52.2 p30 -122.16 90.0 3.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.443 HG22 ' O ' ' C' ' 4' ' ' ILE . 2.9 mm -78.82 -12.36 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.691 ' O ' ' CG1' ' C' ' 9' ' ' VAL . 2.9 p90 -100.43 -50.62 3.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.589 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' C' ' 5' ' ' TYR . 0.7 OUTLIER -62.46 -26.25 68.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.546 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -77.03 -43.59 34.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.1 -49.75 76.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.55 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.7 HG22 ' N ' ' C' ' 10' ' ' GLU . 1.9 m -46.98 -52.63 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.598 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.7 ' N ' HG22 ' C' ' 9' ' ' VAL . 46.5 tp10 -63.28 -29.9 71.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.566 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -93.32 44.15 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.569 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.576 ' O ' ' NZ ' ' C' ' 17' ' ' LYS . 0.2 OUTLIER -108.25 140.37 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.597 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -101.06 159.02 15.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.538 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -50.34 -21.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.607 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.25 -37.55 83.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.541 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.39 -59.94 2.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.535 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . 0.576 ' NZ ' ' O ' ' C' ' 12' ' ' LEU . 30.0 mttp -41.73 -51.39 4.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.553 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -46.21 -29.72 1.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -83.07 -48.19 10.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.544 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.655 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.2 -35.39 78.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.655 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 14.3 tptt -62.46 -23.06 66.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.608 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.44 -66.56 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.562 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.79 -52.26 60.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -39.7 -37.48 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -72.48 -56.4 5.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.574 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 75.1 mt -63.48 -21.41 28.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.591 ' CE2' HD21 ' C' ' 41' ' ' LEU . 3.0 m-85 -73.94 -29.44 62.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 0.643 HG12 ' O ' ' C' ' 35' ' ' CYS . 10.4 m -114.79 34.37 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 5.5 tp -71.91 84.64 0.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.7 5.73 7.54 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.73 173.06 3.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.747 0.308 . . . . 0.0 110.553 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -98.5 -45.95 5.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.507 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' C' ' 34' ' ' GLY . 33.3 p-10 -106.54 -46.71 3.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.529 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . 0.551 ' N ' ' OD1' ' C' ' 33' ' ' ASP . . . 143.53 47.75 0.04 OUTLIER Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 0.643 ' O ' HG12 ' C' ' 28' ' ' VAL . 3.7 m -130.7 -171.43 2.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.776 0.322 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 1.152 ' O ' HD13 ' C' ' 36' ' ' ILE . 0.0 OUTLIER -129.01 150.23 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.533 -180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 1.117 ' O ' HG22 ' C' ' 38' ' ' THR . 25.2 t -154.29 44.51 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.596 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 1.117 HG22 ' O ' ' C' ' 37' ' ' SER . 0.9 OUTLIER 70.37 -56.26 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.747 ' N ' ' CG2' ' C' ' 38' ' ' THR . 55.6 tttp -41.52 -40.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.566 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -93.2 -39.15 11.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.571 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.591 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -58.77 -60.22 4.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.613 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.97 -41.71 7.61 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -43.33 -40.21 3.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.755 0.312 . . . . 0.0 110.574 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.551 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -73.36 -39.85 55.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.548 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.554 ' O ' ' N ' ' C' ' 48' ' ' LEU . 27.9 mmt -44.62 -62.59 1.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.554 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.481 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 39.5 ttm180 -38.0 -38.85 0.34 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 1.1 tmm? -82.38 -31.65 29.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.662 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.57 -8.15 39.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.536 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.34 17.43 29.2 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.624 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 14.8 tt0 -141.88 -166.46 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.769 0.318 . . . . 0.0 110.585 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.624 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 0.7 OUTLIER -177.51 80.79 0.24 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.562 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.534 ' HG2' HD22 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.25 157.09 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.868 2.379 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.8 165.05 47.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.557 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.58 -18.29 25.74 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.85 2.367 . . . . 0.0 112.078 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -83.59 -28.69 28.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.558 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' C' ' 57' ' ' LEU . 96.9 mt-10 -94.31 -42.74 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.597 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.801 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.78 -43.17 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.602 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . 0.854 ' O ' HG22 ' C' ' 61' ' ' ILE . 14.9 mm100 -40.81 -37.72 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -51.34 -40.63 59.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.565 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' C' ' 60' ' ' MET . 0.5 OUTLIER -64.55 -21.46 66.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.559 179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.854 HG22 ' O ' ' C' ' 58' ' ' GLN . 0.0 OUTLIER -100.21 -43.24 10.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.468 ' N ' HG23 ' C' ' 61' ' ' ILE . 21.5 t70 -65.5 -14.68 61.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -73.66 -17.64 61.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.548 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.6 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 16.5 m -145.87 51.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.57 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 45.3 t0 -116.1 83.59 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.526 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -99.91 32.89 2.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.575 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.434 ' OD1' ' OD1' ' C' ' 65' ' ' ASP . 56.7 p30 -138.42 -9.58 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.402 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 58.51 49.01 81.02 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 51.2 p -110.21 -33.69 6.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.584 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.575 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 104.73 -34.12 6.04 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' C' ' 36' ' ' ILE . 2.4 p -100.34 152.55 20.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.549 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.908 ' HB ' HD12 ' C' ' 36' ' ' ILE . 1.0 OUTLIER -98.73 153.36 4.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.557 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.7 m-20 -135.86 178.74 6.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -52.39 -20.4 2.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.57 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -81.26 -50.33 9.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.532 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.6 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.5 mt-10 -77.62 -45.78 24.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.589 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.422 ' HB2' ' CG1' ' C' ' 72' ' ' VAL . 36.3 t80 -52.52 -55.89 18.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.572 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' C' ' 81' ' ' MET . 18.1 tp -41.83 -58.0 2.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.576 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.504 ' O ' HG22 ' C' ' 82' ' ' VAL . 61.0 t -52.53 -44.38 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.559 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.446 ' HE1' HH21 ' C' ' 83' ' ' ARG . 12.6 tpt -49.14 -16.49 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.519 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.596 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -92.8 -47.41 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.555 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.508 ' CG2' ' N ' ' C' ' 83' ' ' ARG . 1.0 OUTLIER -57.35 -40.32 73.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.564 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.508 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 70.1 ttp85 -59.46 -32.84 70.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.614 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -108.62 44.02 1.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.551 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 44.9 ttp -60.6 -75.25 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -136.0 145.13 45.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.551 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 37.2 p-10 -87.57 118.63 27.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.592 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.71 35.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.546 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.589 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 77.2 mtm180 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.587 ' SD ' ' O ' ' I' ' 116' ' ' MET . 0.3 OUTLIER -90.79 106.0 18.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.564 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 19.9 t -67.54 139.51 56.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.543 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.669 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -48.56 -31.64 6.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.536 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 88.1 m-20 -63.69 -43.57 96.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.501 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.27 -51.45 30.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.558 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.501 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 35.6 ttp -55.55 -21.97 19.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.564 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.669 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.2 mp -85.24 -29.51 24.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.534 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.7 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 86.6 mttt -73.03 -41.75 63.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.83 -76.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.564 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.632 ' N ' HD12 ' I' ' 125' ' ' LEU . 9.5 mp -45.32 -47.11 13.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.593 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.592 HD12 ' N ' ' I' ' 126' ' ' LEU . 9.8 mp -106.0 35.0 3.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.568 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.7 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -62.83 -33.61 87.44 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 18.9 t -59.34 -42.55 91.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.333 . . . . 0.0 110.535 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.31 126.65 23.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.565 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -168.13 143.92 3.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.558 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.959 -1.019 . . . . 0.0 110.565 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.575 ' O ' ' OD1' ' C' ' 2' ' ' ASP . 92.3 mmm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.575 ' OD1' ' O ' ' C' ' 1' ' ' MET . 79.1 m-20 -145.98 -164.07 1.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.557 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . 0.589 ' OD1' ' O ' ' C' ' 3' ' ' ASP . 46.2 p-10 -121.51 90.12 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.439 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.7 mt -78.51 -13.27 13.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.592 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' C' ' 5' ' ' TYR . 0.0 OUTLIER -99.22 -50.65 4.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.778 ' O ' HG22 ' C' ' 9' ' ' VAL . 21.1 mmtt -62.22 -27.16 68.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . 0.597 ' O ' ' NE2' ' C' ' 11' ' ' GLN . . . -75.85 -45.39 35.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.593 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -50.62 72.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.567 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.828 ' O ' HD23 ' C' ' 12' ' ' LEU . 19.5 m -45.89 -56.46 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.761 ' N ' HG23 ' C' ' 9' ' ' VAL . 46.3 tp10 -59.97 -29.53 68.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.601 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' C' ' 7' ' ' ALA . 1.9 mp0 -93.78 44.41 1.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.569 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.937 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -109.3 139.6 44.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.569 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . 0.504 HG22 ' N ' ' C' ' 14' ' ' GLU . 36.2 m -99.34 160.47 14.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.504 ' N ' HG22 ' C' ' 13' ' ' THR . 82.7 tt0 -51.96 -20.4 2.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.576 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -67.78 -40.2 83.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' C' ' 19' ' ' GLU . 56.3 mt-30 -83.2 -58.3 2.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.585 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . 0.578 ' HB2' HD13 ' C' ' 12' ' ' LEU . 80.2 tttt -43.23 -49.74 6.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.552 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -47.93 -30.9 4.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.543 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 90.8 mt-10 -79.2 -51.71 9.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.599 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' C' ' 20' ' ' PHE . 6.5 m-85 -55.96 -48.54 75.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.563 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -47.9 -30.79 4.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -58.52 -67.06 0.39 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.603 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.63 -52.06 63.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.628 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -39.91 -40.39 1.0 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.648 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -68.87 -58.64 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 79.4 mt -60.94 -25.17 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.61 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.793 ' CE2' HD21 ' C' ' 41' ' ' LEU . 2.6 m-85 -71.55 -29.06 64.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.587 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.193 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.69 34.02 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.604 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 6.8 tp -73.96 88.52 1.86 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.554 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.58 6.04 10.76 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 1.163 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.788 0.328 . . . . 0.0 110.559 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -97.8 -46.74 5.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.54 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -106.17 -44.65 4.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.582 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . 0.512 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.61 48.17 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 1.193 ' O ' HG23 ' C' ' 28' ' ' VAL . 3.9 m -130.87 -169.91 2.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.759 0.314 . . . . 0.0 110.603 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.498 ' O ' ' OG1' ' C' ' 71' ' ' THR . 2.9 mt -126.07 155.49 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.546 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.7 ' C ' HG23 ' C' ' 38' ' ' THR . 19.0 t -159.78 38.08 0.19 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.559 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.775 HG22 HD12 ' C' ' 57' ' ' LEU . 1.4 p 73.02 -55.6 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.561 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.444 ' N ' ' OG1' ' C' ' 38' ' ' THR . 21.4 tptp -42.11 -39.72 2.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -93.3 -40.82 10.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.793 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -57.34 -61.09 2.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.599 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.52 -40.77 6.5 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -45.02 -39.11 5.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.577 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.723 HG22 ' SD ' ' C' ' 45' ' ' MET . 0.9 OUTLIER -75.91 -34.38 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.586 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.723 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -49.78 -60.37 2.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.524 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.506 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 3.7 ptt-85 -40.51 -36.29 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.53 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . 0.401 ' N ' ' CG ' ' C' ' 46' ' ' ARG . 4.3 ttp -83.91 -30.15 26.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.566 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.718 ' O ' HD23 ' C' ' 48' ' ' LEU . 1.0 OUTLIER -69.19 -10.67 58.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.562 -179.953 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.88 17.26 21.45 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 1.3 tp-100 -143.48 -166.0 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.779 0.324 . . . . 0.0 110.541 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' C' ' 50' ' ' GLN . 7.2 m-20 -176.77 82.64 0.26 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.568 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 55.2 Cg_endo -73.8 158.69 46.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 122.813 2.342 . . . . 0.0 112.115 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' C' ' 57' ' ' LEU . 0.2 OUTLIER -82.93 164.38 46.77 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -72.3 -16.66 27.93 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.121 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -85.39 -30.95 23.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.559 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.517 ' OE2' ' CB ' ' C' ' 52' ' ' PRO . 7.1 pt-20 -93.77 -37.1 11.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.54 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.814 HD13 ' O ' ' C' ' 57' ' ' LEU . 0.5 OUTLIER -40.69 -43.26 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . 0.559 ' O ' HG13 ' C' ' 61' ' ' ILE . 94.0 mt-30 -41.0 -36.48 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.574 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.0 -41.38 59.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 62.1 mmm -66.3 -18.42 65.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.787 ' C ' HD12 ' C' ' 61' ' ' ILE . 0.4 OUTLIER -102.91 -34.18 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.573 179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.566 ' N ' HG13 ' C' ' 61' ' ' ILE . 91.3 m-20 -72.03 -25.42 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . 0.63 ' HG3' HG13 ' C' ' 64' ' ' VAL . 18.5 pt-20 -61.44 -24.32 66.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.541 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.709 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 30.1 m -145.82 55.86 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.588 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.586 ' C ' ' H ' ' C' ' 67' ' ' ASP . 46.1 t0 -114.32 52.71 0.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.548 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -66.88 16.99 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 1.127 ' O ' ' N ' ' C' ' 69' ' ' SER . 28.5 m-20 -120.5 12.39 11.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 33.85 -1.98 0.0 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 1.127 ' N ' ' O ' ' C' ' 67' ' ' ASP . 52.0 p -58.8 -46.83 86.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.819 0.342 . . . . 0.0 110.558 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.76 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 126.66 -55.12 0.75 Allowed Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.682 ' OG1' ' CB ' ' C' ' 35' ' ' CYS . 15.3 t -83.73 161.85 20.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 0.0 110.634 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.618 HG13 ' HB2' ' C' ' 76' ' ' GLU . 5.6 t -100.8 160.27 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.583 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.566 ' OD1' ' O ' ' C' ' 72' ' ' VAL . 97.8 m-20 -143.19 176.83 8.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.575 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.527 ' O ' HD12 ' C' ' 78' ' ' LEU . 48.7 p90 -51.89 -22.24 3.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.57 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' C' ' 75' ' ' ASP . 0.1 OUTLIER -78.62 -50.04 12.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.583 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.709 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 97.2 mt-10 -79.48 -41.65 26.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.5 -57.84 9.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.591 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.527 HD12 ' O ' ' C' ' 74' ' ' PHE . 44.7 mt -41.29 -61.01 1.1 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.594 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.553 ' O ' HG22 ' C' ' 82' ' ' VAL . 58.2 t -47.5 -44.08 9.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.596 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.728 ' SD ' ' O ' ' C' ' 80' ' ' MET . 1.2 tmm? -50.44 -17.29 0.46 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.636 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.445 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 22.6 mmt -92.16 -46.7 7.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.553 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.1 m -58.61 -38.6 72.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.548 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 18.3 mmt85 -60.55 -31.82 70.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.594 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 99.6 m -110.18 42.6 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.55 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 50.9 ttm -58.31 -75.61 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.58 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -135.67 145.44 46.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.79 118.55 27.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.556 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -154.47 35.6 0.41 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.532 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.22 -0.457 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.552 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . 0.424 ' NH1' ' O ' ' I' ' 116' ' ' MET . 63.9 ttt-85 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.456 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 2.4 ptt? -102.46 147.02 27.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.543 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 25.6 m -114.82 146.86 40.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.568 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.649 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.13 -37.16 6.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.566 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -62.86 -44.7 95.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -71.1 -49.49 43.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.534 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.582 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.8 ttp -55.8 -26.26 45.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.515 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 126' ' ' LEU . 1.3 mp -79.9 -27.3 39.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.54 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.414 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 73.5 mttt -74.56 -49.47 21.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.573 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -71.26 -75.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.574 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.651 ' HB3' HD23 ' I' ' 126' ' ' LEU . 10.7 mp -41.17 -51.3 3.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.848 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -137.62 85.1 2.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.538 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.414 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -96.68 172.01 28.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 73.02 -52.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.786 0.326 . . . . 0.0 110.567 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -78.37 -2.41 38.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.566 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . 0.505 ' CE1' HD23 ' I' ' 122' ' ' LEU . 85.5 t60 -114.48 136.7 52.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.556 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 57.5 mttp . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.506 -179.953 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.489 ' OD2' HD11 ' C' ' 4' ' ' ILE . 56.1 p30 -146.61 -163.63 1.79 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.519 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -121.83 89.93 3.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.489 HD11 ' OD2' ' C' ' 2' ' ' ASP . 32.4 mm -78.49 -12.3 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.611 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.707 ' O ' HG13 ' C' ' 9' ' ' VAL . 1.7 p90 -100.1 -51.14 3.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.51 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.795 ' O ' HG22 ' C' ' 9' ' ' VAL . 44.8 tttp -62.01 -26.77 68.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.488 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.09 -45.65 32.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.566 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.3 -50.33 74.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.545 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.795 HG22 ' O ' ' C' ' 6' ' ' LYS . 10.9 m -46.37 -54.39 2.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.741 ' N ' HG23 ' C' ' 9' ' ' VAL . 94.6 mt-10 -61.84 -28.42 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.528 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -94.88 43.98 1.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.571 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.77 139.1 44.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 17.8 p -98.47 160.88 13.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.597 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.467 ' OE2' ' OD1' ' C' ' 18' ' ' ASN . 40.0 tp10 -52.5 -19.81 2.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.585 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.12 -38.67 82.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . 0.417 ' O ' ' N ' ' C' ' 19' ' ' GLU . 91.4 mm-40 -84.98 -58.54 2.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.53 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -43.2 -47.43 6.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.548 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . 0.467 ' OD1' ' OE2' ' C' ' 14' ' ' GLU . 40.3 m-20 -49.64 -31.75 11.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.585 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' C' ' 22' ' ' ALA . 92.5 mt-10 -78.52 -51.64 9.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.596 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.591 ' CG ' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -55.55 -50.03 71.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.576 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.591 ' N ' ' CG ' ' C' ' 20' ' ' PHE . 21.5 tttm -47.15 -28.36 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.617 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -60.31 -68.36 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.589 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' C' ' 24' ' ' PHE . . . -54.37 -53.12 58.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.604 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 0.591 ' O ' HG13 ' C' ' 28' ' ' VAL . 83.8 t80 -38.85 -36.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.573 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 t0 -73.87 -55.87 5.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 80.3 mt -63.82 -20.19 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.614 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.8 m-85 -75.9 -28.52 58.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 0.731 ' O ' HG23 ' C' ' 28' ' ' VAL . 1.4 m -113.76 32.14 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.586 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . 0.577 HD23 ' C ' ' C' ' 29' ' ' LEU . 4.9 tt -70.44 85.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.614 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.7 5.84 8.17 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.919 -0.872 . . . . 0.0 110.919 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.86 172.12 3.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 0.0 110.551 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -98.05 -46.32 5.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -106.14 -45.45 4.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.564 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.95 45.8 0.05 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 0.678 ' C ' HD13 ' C' ' 36' ' ' ILE . 4.0 m -128.19 -169.48 2.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.803 0.335 . . . . 0.0 110.605 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 1.019 ' CG1' HG13 ' C' ' 72' ' ' VAL . 0.0 OUTLIER -130.29 148.68 33.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.56 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.615 ' C ' HG23 ' C' ' 38' ' ' THR . 6.1 t -153.82 47.4 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.538 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.615 HG23 ' C ' ' C' ' 37' ' ' SER . 1.5 p 68.74 -60.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.552 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.505 ' N ' ' OG1' ' C' ' 38' ' ' THR . 32.6 mttp -38.6 -36.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 52.7 mp0 -95.27 -39.16 10.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.568 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 1.175 ' H ' ' CD2' ' C' ' 41' ' ' LEU . 0.0 OUTLIER -56.93 -62.97 1.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.594 179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' C' ' 45' ' ' MET . . . -41.91 -51.11 5.05 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' C' ' 42' ' ' GLY . 13.9 tttp -35.6 -43.03 0.26 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.775 0.322 . . . . 0.0 110.555 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.737 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -74.22 -35.65 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.519 -179.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.737 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -50.44 -59.71 3.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.529 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 0.0 OUTLIER -40.07 -38.02 0.68 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.582 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 2.7 ttt -82.88 -30.5 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.599 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.765 ' O ' HD23 ' C' ' 48' ' ' LEU . 1.1 tt -69.01 -8.31 43.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.594 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.52 18.97 24.27 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.585 ' HG2' ' H ' ' C' ' 51' ' ' ASN . 2.5 tt0 -144.35 -167.13 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.801 0.334 . . . . 0.0 110.555 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.585 ' H ' ' HG2' ' C' ' 50' ' ' GLN . 4.2 t30 -176.24 82.42 0.28 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.586 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.702 ' HG2' HD23 ' C' ' 57' ' ' LEU . 54.0 Cg_endo -73.41 159.85 45.77 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.805 2.337 . . . . 0.0 112.14 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.2 164.33 44.02 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.22 -17.21 27.9 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 C-N-CA 122.818 2.345 . . . . 0.0 112.087 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -85.39 -29.86 24.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.541 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.453 ' O ' ' C ' ' C' ' 57' ' ' LEU . 47.4 tp10 -92.55 -41.99 9.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.702 HD23 ' HG2' ' C' ' 52' ' ' PRO . 0.2 OUTLIER -36.01 -47.94 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.569 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . 0.747 ' O ' ' CG2' ' C' ' 61' ' ' ILE . 93.9 mt-30 -36.59 -36.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.546 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' C' ' 63' ' ' GLU . 81.4 tt0 -53.49 -38.61 63.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.51 ' N ' ' O ' ' C' ' 57' ' ' LEU . 47.2 mtt -66.45 -22.69 66.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.514 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.795 ' CD1' ' O ' ' C' ' 70' ' ' GLY . 0.0 OUTLIER -99.39 -42.41 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.442 ' N ' HG23 ' C' ' 61' ' ' ILE . 56.1 t0 -65.45 -14.97 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.586 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' C' ' 59' ' ' GLU . 25.8 mm-40 -73.86 -16.99 61.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.512 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 27.7 m -146.13 48.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.569 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.61 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 67.4 t0 -113.73 85.09 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.563 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' C' ' 66' ' ' GLU . 22.2 pt-20 -101.2 34.42 2.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.627 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 37.5 p30 -135.57 -23.78 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.627 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 79.35 15.38 80.14 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 14.6 p -79.34 -38.79 34.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 0.0 110.56 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.795 ' O ' ' CD1' ' C' ' 61' ' ' ILE . . . 108.39 -34.32 5.67 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . . . . . . . . . 2.4 p -98.9 147.77 24.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.772 0.32 . . . . 0.0 110.595 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 1.019 HG13 ' CG1' ' C' ' 36' ' ' ILE . 0.5 OUTLIER -93.78 150.0 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -131.42 -175.36 3.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.976 ' O ' HD23 ' C' ' 78' ' ' LEU . 53.4 p90 -57.01 -17.11 8.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.589 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . 0.708 ' HA ' HD21 ' C' ' 78' ' ' LEU . 55.9 t0 -87.05 -45.78 10.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.639 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 96.1 mt-10 -81.52 -33.19 31.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.496 ' O ' ' N ' ' C' ' 80' ' ' MET . 46.6 t80 -64.37 -63.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 1.368 HD12 ' N ' ' C' ' 79' ' ' VAL . 3.0 pp -37.12 -48.72 0.84 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.587 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 1.368 ' N ' HD12 ' C' ' 78' ' ' LEU . 18.2 t -58.96 -41.02 81.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.582 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.496 ' N ' ' O ' ' C' ' 77' ' ' PHE . 10.3 tpt -55.43 -16.73 3.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.533 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.615 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -90.94 -46.08 8.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.575 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.557 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -58.87 -40.51 80.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.561 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.511 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 10.3 tpt180 -59.69 -30.67 68.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.532 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 64.9 m -111.13 42.12 1.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.579 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.6 ttt -59.09 -76.52 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.548 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -133.28 146.35 51.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.547 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -89.69 117.28 28.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.559 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.402 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.0 p30 -153.14 36.03 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.588 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 68.4 m . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.573 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.501 ' C ' ' SD ' ' I' ' 116' ' ' MET . 0.0 OUTLIER -98.44 137.56 36.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.527 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -109.34 145.79 35.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.605 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.651 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -46.24 -36.08 5.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.552 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -62.72 -43.16 99.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.553 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -75.32 -49.48 19.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.494 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.532 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 32.4 ttp -55.32 -24.25 27.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.533 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.651 HD13 ' O ' ' I' ' 118' ' ' ALA . 2.5 mp -80.67 -33.49 35.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.573 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.769 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 9.7 mtmp? -75.01 -41.62 59.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.529 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.75 -69.04 0.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.57 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.631 ' N ' HD12 ' I' ' 125' ' ' LEU . 9.6 mp -57.62 -46.69 83.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.535 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.559 ' HB2' ' O ' ' I' ' 122' ' ' LEU . 8.4 mt -107.8 41.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.561 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.769 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -64.67 -29.71 75.95 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 72.2 p -100.91 -29.76 12.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.756 0.312 . . . . 0.0 110.543 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -99.88 16.34 24.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.583 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -54.21 -40.31 67.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 61.6 tttm . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.604 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.62 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 44.1 t0 -146.73 -164.78 2.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.581 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . 0.62 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 3.1 m-20 -120.76 90.46 3.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . 15.0 tt -79.28 -13.65 13.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.631 ' O ' HG13 ' C' ' 9' ' ' VAL . 3.7 m-85 -98.81 -49.71 4.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.797 ' O ' HG22 ' C' ' 9' ' ' VAL . 31.2 tttp -63.33 -27.22 69.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.579 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.58 -44.68 41.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.551 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.84 -49.96 75.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.546 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.815 ' O ' HD23 ' C' ' 12' ' ' LEU . 18.1 m -46.29 -56.21 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.577 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.763 ' N ' HG23 ' C' ' 9' ' ' VAL . 45.7 tp10 -60.16 -29.38 68.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.549 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -94.1 45.27 1.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.536 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.941 ' O ' HD12 ' C' ' 12' ' ' LEU . 4.6 pp -110.26 140.22 44.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.92 160.49 14.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.583 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -52.18 -20.04 2.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.568 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . 0.408 ' CD ' ' O ' ' C' ' 15' ' ' GLU . 2.7 tm-20 -67.72 -39.44 84.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.584 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -84.46 -58.92 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.584 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . 0.583 ' HB2' HD13 ' C' ' 12' ' ' LEU . 49.9 tttp -42.94 -48.29 5.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.596 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . 0.486 ' OD1' ' NZ ' ' I' ' 129' ' ' LYS . 25.6 t-20 -49.72 -27.61 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.571 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -85.14 -46.84 10.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.582 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.648 ' CD1' ' N ' ' C' ' 21' ' ' LYS . 0.0 OUTLIER -62.37 -35.17 78.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.555 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . 0.648 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 61.5 tttm -62.33 -24.97 67.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.602 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.25 -66.31 0.56 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.613 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.23 -52.54 61.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -39.68 -37.17 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.621 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -72.84 -55.94 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.578 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 70.4 mt -63.88 -21.16 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.569 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.409 ' O ' ' CB ' ' C' ' 40' ' ' GLU . 3.4 m-85 -74.51 -29.37 61.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 0.614 ' O ' HG23 ' C' ' 28' ' ' VAL . 2.6 m -114.45 33.86 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.599 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 2.1 mt -71.99 83.96 0.97 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 124.68 6.1 6.74 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.96 171.65 5.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.777 0.322 . . . . 0.0 110.56 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER -97.11 -45.86 6.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.58 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -106.61 -44.09 4.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.57 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . . . . . . . . . . . 138.76 48.77 0.06 OUTLIER Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 0.827 ' HB2' ' OG1' ' C' ' 71' ' ' THR . 28.2 p -129.06 -167.15 1.74 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.557 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.548 ' O ' ' HA ' ' C' ' 71' ' ' THR . 0.1 OUTLIER -129.23 150.7 34.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.597 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 0.909 ' O ' HG22 ' C' ' 38' ' ' THR . 29.6 m -156.95 41.43 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.569 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 0.912 ' OG1' HD13 ' C' ' 57' ' ' LEU . 0.6 OUTLIER 69.29 -56.6 0.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.558 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.773 ' N ' ' CG2' ' C' ' 38' ' ' THR . 34.0 mmtt -40.19 -39.91 1.01 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.597 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' C' ' 40' ' ' GLU . 41.7 mp0 -93.87 -38.66 11.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.554 ' O ' HG22 ' C' ' 44' ' ' VAL . 1.6 tt -59.01 -59.74 4.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.567 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -45.65 -41.23 9.46 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 tttm -44.19 -38.89 4.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.813 0.34 . . . . 0.0 110.559 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.554 HG22 ' O ' ' C' ' 41' ' ' LEU . 0.9 OUTLIER -74.76 -39.41 45.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.586 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.544 ' O ' ' N ' ' C' ' 48' ' ' LEU . 31.1 mmt -45.29 -62.3 1.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.576 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 53.8 ttt85 -38.79 -36.5 0.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 3.4 ttt -84.22 -31.82 24.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.59 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' I' ' 121' ' ' MET . 3.8 tp -68.03 -11.51 59.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.553 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.76 18.02 17.11 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.499 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.6 mt-30 -144.22 -166.75 2.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.782 0.325 . . . . 0.0 110.521 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.471 HD21 ' HB2' ' C' ' 46' ' ' ARG . 0.8 OUTLIER -176.14 81.73 0.28 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.506 ' CD ' ' HG3' ' C' ' 45' ' ' MET . 53.7 Cg_endo -73.4 156.01 50.53 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.799 2.333 . . . . 0.0 112.115 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.72 164.43 53.42 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.575 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.52 -18.77 25.55 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.813 2.342 . . . . 0.0 112.076 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -83.03 -30.43 28.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.585 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' C' ' 57' ' ' LEU . 97.2 mt-10 -93.21 -40.53 10.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.912 HD13 ' OG1' ' C' ' 38' ' ' THR . 1.0 OUTLIER -38.57 -42.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.612 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -40.74 -35.19 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.597 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.6 tp10 -52.97 -43.06 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.564 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.46 -15.23 60.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.6 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.591 HG21 ' O ' ' C' ' 70' ' ' GLY . 90.4 mt -104.59 -41.09 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.57 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -69.83 -14.26 62.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.534 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . 0.658 ' HG3' HG22 ' C' ' 64' ' ' VAL . 1.1 pt-20 -73.46 -16.1 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.543 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.658 HG22 ' HG3' ' C' ' 63' ' ' GLU . 11.4 m -147.56 51.04 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.54 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -116.33 80.77 1.51 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.539 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -94.31 27.0 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.578 ' OD1' ' C ' ' C' ' 67' ' ' ASP . 33.8 p30 -144.68 22.57 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.584 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.576 ' C ' ' O ' ' C' ' 67' ' ' ASP . . . 23.26 72.13 0.01 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . . . . . . . . . 60.7 p -123.94 -31.23 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.757 0.313 . . . . 0.0 110.536 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.591 ' O ' HG21 ' C' ' 61' ' ' ILE . . . 102.64 -33.3 6.67 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.827 ' OG1' ' HB2' ' C' ' 35' ' ' CYS . 6.1 t -105.85 153.12 22.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.813 0.34 . . . . 0.0 110.556 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.534 HG23 HG23 ' C' ' 61' ' ' ILE . 0.9 OUTLIER -99.26 156.69 3.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.585 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . 0.465 ' N ' ' CG1' ' C' ' 72' ' ' VAL . 86.5 m-20 -138.06 178.99 6.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.498 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' C' ' 78' ' ' LEU . 48.2 p90 -53.64 -21.83 7.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.528 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -79.18 -49.09 13.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.553 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 95.2 mt-10 -78.87 -44.04 23.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.575 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -53.33 -57.62 9.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.588 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.6 HD13 ' O ' ' C' ' 78' ' ' LEU . 0.2 OUTLIER -40.32 -59.99 1.18 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.59 179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . . . . . . . . . 69.6 t -50.13 -45.09 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.598 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.574 ' O ' ' SG ' ' C' ' 84' ' ' CYS . 0.5 OUTLIER -48.0 -20.94 0.38 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.577 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.631 ' SD ' ' N ' ' C' ' 81' ' ' MET . 0.0 OUTLIER -89.07 -46.63 8.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.568 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 64.8 t -57.38 -42.54 80.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.571 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -57.41 -32.06 66.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.553 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' C' ' 80' ' ' MET . 3.6 p -110.38 45.8 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.65 -74.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.539 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 59.2 mttp -134.55 145.4 48.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.516 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . 0.493 ' O ' ' OD1' ' C' ' 88' ' ' ASP . 54.4 t0 -88.98 117.04 27.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.568 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.493 ' OD1' ' O ' ' C' ' 87' ' ' ASP . 71.9 m-20 -153.47 36.41 0.46 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.599 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.569 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' I' ' 116' ' ' MET . 83.7 mtm-85 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.519 ' O ' ' O ' ' I' ' 115' ' ' ARG . 0.0 OUTLIER 55.95 125.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.561 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' I' ' 118' ' ' ALA . 73.7 m -76.06 19.53 0.22 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.61 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.562 ' HB2' ' SG ' ' C' ' 84' ' ' CYS . . . 71.15 -51.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -56.35 -45.64 80.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.54 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.67 85.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.537 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.752 ' HA ' HD11 ' C' ' 48' ' ' LEU . 33.4 ttp -66.02 -19.98 66.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.547 ' CD1' ' N ' ' I' ' 122' ' ' LEU . 0.2 OUTLIER -89.36 -25.85 21.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.528 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.593 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 45.6 mttm -67.58 -44.54 77.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.593 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . 0.671 ' HB3' HD12 ' C' ' 48' ' ' LEU . . . -80.46 -73.98 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.572 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.407 ' N ' HD23 ' I' ' 125' ' ' LEU . 6.6 mt -39.39 -49.0 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.559 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' I' ' 122' ' ' LEU . 0.0 OUTLIER -139.0 70.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.592 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.593 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -78.18 -30.82 49.46 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . . . . . . . . . 15.7 m -63.75 -39.6 94.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 110.564 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . 0.486 ' NZ ' ' OD1' ' C' ' 18' ' ' ASN . 7.7 ttpp -125.01 118.03 25.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.583 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -152.63 -68.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.576 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . . . . . . . . . 17.2 tptm . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.938 -1.03 . . . . 0.0 110.578 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . 0.412 ' HG3' ' H ' ' C' ' 2' ' ' ASP . 1.2 tpp . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' ASP . . . . . 0.625 ' CG ' ' H ' ' C' ' 3' ' ' ASP . 43.9 t0 -146.35 -163.95 1.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.564 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' ASP . . . . . 0.625 ' H ' ' CG ' ' C' ' 2' ' ' ASP . 44.5 m-20 -121.71 90.37 3.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.578 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' ILE . . . . . 0.452 HG22 ' O ' ' C' ' 4' ' ' ILE . 87.0 mt -79.1 -12.1 13.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.519 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' TYR . . . . . 0.605 ' O ' HG13 ' C' ' 9' ' ' VAL . 2.0 p90 -100.44 -50.45 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.549 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' LYS . . . . . 0.774 ' O ' HG22 ' C' ' 9' ' ' VAL . 16.1 tptt -62.85 -25.91 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' ALA . . . . . 0.539 ' O ' ' CG ' ' C' ' 10' ' ' GLU . . . -77.22 -44.2 30.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.544 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.83 -47.77 84.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.774 HG22 ' O ' ' C' ' 6' ' ' LYS . 24.6 m -47.72 -57.2 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.531 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' GLU . . . . . 0.75 ' N ' HG23 ' C' ' 9' ' ' VAL . 18.9 pt-20 -61.03 -26.66 67.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.19 42.83 1.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.574 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' C' ' 9' ' ' VAL . 0.6 OUTLIER -108.73 141.65 40.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.532 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' THR . . . . . . . . . . . . . 1.2 m -100.59 160.09 14.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.587 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -51.72 -19.87 1.83 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.59 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.1 -39.44 82.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.578 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' C' ' 19' ' ' GLU . 61.5 mt-30 -84.29 -59.08 2.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -42.81 -47.85 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.577 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -49.86 -31.48 12.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.524 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.473 ' OE2' ' O ' ' I' ' 131' ' ' LYS . 88.3 mt-10 -79.75 -51.06 9.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.558 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.481 ' N ' ' CD1' ' C' ' 20' ' ' PHE . 10.0 m-30 -57.85 -43.54 85.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.598 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -52.98 -26.63 15.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.575 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' C' ' 19' ' ' GLU . . . -63.27 -65.0 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.606 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.95 -52.07 61.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' PHE . . . . . 0.875 ' CZ ' ' CE2' ' C' ' 74' ' ' PHE . 72.1 t80 -40.41 -42.23 1.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -65.78 -58.9 4.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.613 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' ILE . . . . . . . . . . . . . 68.4 mt -61.41 -25.07 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.573 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.749 ' O ' ' HB3' ' C' ' 40' ' ' GLU . 2.3 m-85 -70.78 -30.34 66.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.585 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' VAL . . . . . 1.242 HG23 ' O ' ' C' ' 35' ' ' CYS . 0.3 OUTLIER -113.32 34.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.562 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' LEU . . . . . 0.551 ' O ' ' OE2' ' C' ' 40' ' ' GLU . 32.7 tp -73.75 87.89 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.537 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' GLY . . . . . . . . . . . . . . . 119.93 6.41 10.16 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' ALA . . . . . 1.187 ' CB ' HG22 ' C' ' 28' ' ' VAL . . . -67.35 172.48 4.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -97.69 -46.33 6.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.584 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -106.62 -44.84 4.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.55 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' GLY . . . . . 0.506 ' C ' HG21 ' C' ' 28' ' ' VAL . . . 140.67 48.44 0.05 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' CYS . . . . . 1.242 ' O ' HG23 ' C' ' 28' ' ' VAL . 4.8 m -130.28 -169.04 2.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.577 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' ILE . . . . . 0.793 ' HB ' HG13 ' C' ' 72' ' ' VAL . 1.3 mp -127.6 154.03 37.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.616 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' SER . . . . . 1.132 ' O ' HG22 ' C' ' 38' ' ' THR . 37.6 m -159.59 41.56 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.626 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' THR . . . . . 1.132 HG22 ' O ' ' C' ' 37' ' ' SER . 1.0 OUTLIER 69.76 -56.75 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' LYS . . . . . 0.755 ' N ' ' CG2' ' C' ' 38' ' ' THR . 9.2 pttt -41.17 -39.45 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.579 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' GLU . . . . . 0.749 ' HB3' ' O ' ' C' ' 27' ' ' PHE . 1.2 tp10 -94.64 -38.6 10.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.548 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.745 HD21 ' CE2' ' C' ' 27' ' ' PHE . 0.5 OUTLIER -59.58 -60.98 2.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.562 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 42' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' C' ' 45' ' ' MET . . . -44.96 -39.84 6.61 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 43' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -45.19 -38.04 5.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.809 0.337 . . . . 0.0 110.544 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 44' ' ' VAL . . . . . 0.705 HG22 ' SD ' ' C' ' 45' ' ' MET . 1.0 OUTLIER -77.04 -35.49 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.572 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 45' ' ' MET . . . . . 0.705 ' SD ' HG22 ' C' ' 44' ' ' VAL . 0.0 OUTLIER -48.64 -60.24 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.592 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 46' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' C' ' 50' ' ' GLN . 92.9 mtt180 -40.4 -36.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.575 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 47' ' ' MET . . . . . . . . . . . . . 6.1 ttp -83.24 -30.56 27.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.591 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.668 ' O ' HD23 ' C' ' 48' ' ' LEU . 0.9 OUTLIER -68.32 -12.8 61.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.595 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.15 17.1 16.81 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 50' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' C' ' 46' ' ' ARG . 92.4 mt-30 -143.16 -164.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.799 0.333 . . . . 0.0 110.539 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 51' ' ' ASN . . . . . 0.517 ' N ' ' ND2' ' C' ' 51' ' ' ASN . 0.1 OUTLIER -177.93 81.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.595 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 52' ' ' PRO . . . . . 0.655 ' CD ' ' HG2' ' C' ' 45' ' ' MET . 54.1 Cg_endo -73.46 154.33 50.43 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 122.866 2.377 . . . . 0.0 112.137 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.17 165.24 51.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.523 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.18 -20.72 24.48 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.812 2.341 . . . . 0.0 112.086 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 55' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.19 -28.66 34.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.587 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 56' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' C' ' 57' ' ' LEU . 85.1 tt0 -93.43 -43.35 8.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.62 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 57' ' ' LEU . . . . . 0.797 ' CB ' ' OG1' ' C' ' 38' ' ' THR . 0.1 OUTLIER -35.73 -43.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 179.978 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 58' ' ' GLN . . . . . 0.67 ' O ' HG13 ' C' ' 61' ' ' ILE . 13.7 pt20 -40.9 -35.61 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.602 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -53.63 -39.75 65.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 60' ' ' MET . . . . . 0.416 ' N ' ' O ' ' C' ' 57' ' ' LEU . 13.6 tpp -68.41 -17.24 64.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.591 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 61' ' ' ILE . . . . . 0.873 HD13 ' O ' ' C' ' 70' ' ' GLY . 0.4 OUTLIER -102.75 -38.28 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.567 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 62' ' ' ASP . . . . . 0.615 ' N ' HG13 ' C' ' 61' ' ' ILE . 21.4 t70 -71.96 -14.37 61.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.585 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 63' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -72.63 -17.84 61.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.588 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 64' ' ' VAL . . . . . 0.593 ' O ' ' HB3' ' C' ' 76' ' ' GLU . 17.8 m -145.01 48.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.6 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 65' ' ' ASP . . . . . 0.534 ' OD1' ' OD1' ' C' ' 67' ' ' ASP . 44.2 t0 -113.12 83.7 1.87 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.584 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -98.27 32.23 2.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.55 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 67' ' ' ASP . . . . . 0.586 ' OD1' ' N ' ' C' ' 68' ' ' GLY . 51.6 p30 -136.82 -21.11 1.27 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.568 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 68' ' ' GLY . . . . . 0.586 ' N ' ' OD1' ' C' ' 67' ' ' ASP . . . 86.22 -26.51 6.19 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 69' ' ' SER . . . . . 0.459 ' C ' ' O ' ' C' ' 68' ' ' GLY . 5.3 p -35.53 -51.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.809 0.338 . . . . 0.0 110.544 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 70' ' ' GLY . . . . . 0.873 ' O ' HD13 ' C' ' 61' ' ' ILE . . . 116.67 -35.32 4.25 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 71' ' ' THR . . . . . 0.69 ' OG1' ' HB3' ' C' ' 35' ' ' CYS . 15.2 t -93.31 157.83 16.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.569 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.793 HG13 ' HB ' ' C' ' 36' ' ' ILE . 1.5 m -100.22 151.36 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.62 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 73' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -135.65 -176.47 4.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.533 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 74' ' ' PHE . . . . . 0.914 ' O ' HD12 ' C' ' 78' ' ' LEU . 0.0 OUTLIER -56.19 -16.86 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.593 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -85.61 -51.67 6.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.6 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 76' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' C' ' 64' ' ' VAL . 94.9 mt-10 -76.74 -43.55 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.6 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 77' ' ' PHE . . . . . 0.401 ' O ' ' C ' ' C' ' 78' ' ' LEU . 62.7 t80 -52.65 -58.95 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.579 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 78' ' ' LEU . . . . . 0.914 HD12 ' O ' ' C' ' 74' ' ' PHE . 62.3 mt -39.65 -61.75 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.543 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 79' ' ' VAL . . . . . 0.531 ' O ' HG22 ' C' ' 82' ' ' VAL . 65.5 t -47.64 -45.13 10.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 80' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' C' ' 77' ' ' PHE . 33.3 ttp -48.97 -19.12 0.36 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.584 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 81' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' C' ' 78' ' ' LEU . 0.1 OUTLIER -90.63 -48.13 7.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.606 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 82' ' ' VAL . . . . . 0.531 HG22 ' O ' ' C' ' 79' ' ' VAL . 1.0 OUTLIER -56.76 -38.87 60.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.528 179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 83' ' ' ARG . . . . . 0.482 ' N ' ' CG2' ' C' ' 82' ' ' VAL . 68.5 mtp85 -60.5 -32.5 71.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.43 42.76 1.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 85' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.22 -76.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.544 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 86' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -133.72 145.9 50.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.613 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 87' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -89.41 116.74 27.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.523 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 88' ' ' ASP . . . . . 0.406 ' C ' ' OD1' ' C' ' 88' ' ' ASP . 55.5 p30 -152.81 36.26 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.58 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.567 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 115' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' I' I ' 116' ' ' MET . . . . . 0.494 ' SD ' ' CD1' ' C' ' 48' ' ' LEU . 4.8 ptt? -138.89 145.93 40.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.537 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 117' ' ' SER . . . . . . . . . . . . . 22.6 t -108.1 142.58 38.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.575 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 118' ' ' ALA . . . . . 0.633 ' O ' HD13 ' I' ' 122' ' ' LEU . . . -41.51 -41.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.572 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 119' ' ' ASP . . . . . 0.514 ' CG ' ' NZ ' ' I' ' 123' ' ' LYS . 42.1 t0 -60.43 -50.01 75.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.581 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.81 86.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.584 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 121' ' ' MET . . . . . 0.538 ' O ' ' HB2' ' I' ' 125' ' ' LEU . 39.9 ttp -60.04 -25.51 65.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.567 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 122' ' ' LEU . . . . . 0.633 HD13 ' O ' ' I' ' 118' ' ' ALA . 1.5 mp -82.32 -29.87 30.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 123' ' ' LYS . . . . . 0.69 ' O ' ' CA ' ' I' ' 127' ' ' GLY . 49.3 mttp -71.28 -39.6 71.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.557 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.85 -70.9 0.51 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 125' ' ' LEU . . . . . 0.615 ' N ' HD12 ' I' ' 125' ' ' LEU . 10.1 mp -51.54 -46.98 63.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.581 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 126' ' ' LEU . . . . . 0.62 HD12 ' N ' ' I' ' 126' ' ' LEU . 9.7 mp -105.29 30.41 5.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 127' ' ' GLY . . . . . 0.69 ' CA ' ' O ' ' I' ' 123' ' ' LYS . . . -60.39 81.8 0.02 OUTLIER Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.896 -0.881 . . . . 0.0 110.896 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 128' ' ' SER . . . . . 0.436 ' N ' ' O ' ' I' ' 126' ' ' LEU . 34.5 m -169.16 -120.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.33 . . . . 0.0 110.576 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' I' I ' 129' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -55.5 -37.34 67.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.569 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 130' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 45.02 58.13 4.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' I' I ' 131' ' ' LYS . . . . . 0.473 ' O ' ' OE2' ' C' ' 19' ' ' GLU . 20.4 tptm . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 101' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_