data_1ef4_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 1ef4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.408 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.875 0.369 . . . . 0.0 111.326 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.457 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.422 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.499 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.49 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.499 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.406 ' CB ' ' HB2' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.406 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.411 ' N ' ' O ' ' A' ' 30' ' ' PRO . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.47 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.432 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.422 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.463 ' CA ' ' HB ' ' A' ' 52' ' ' VAL . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.47 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.463 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 10.6 p . . . . . 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.473 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' A' ' 17' ' ' PHE . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.519 ' CZ ' ' CG1' ' A' ' 52' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.442 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.485 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.485 ' HB2' ' CD1' ' A' ' 42' ' ' TYR . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.463 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.473 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.519 ' CG1' ' CZ ' ' A' ' 20' ' ' TYR . 14.5 p . . . . . 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 44' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.44 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.53 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.493 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.426 ' CB ' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.493 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.426 HG22 ' CB ' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.483 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.444 ' CD2' HD13 ' A' ' 48' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.403 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.408 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 39' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.483 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.452 HG11 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 94.5 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.461 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.475 HG23 ' CE1' ' A' ' 17' ' ' PHE . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.503 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 36' ' ' ASP . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.47 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.4 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 48' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.433 ' CE ' HD13 ' A' ' 7' ' ' LEU . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.468 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.496 ' CG1' ' CZ ' ' A' ' 20' ' ' TYR . 13.4 p . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.421 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.881 0.372 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.476 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.48 HG22 ' CE1' ' A' ' 17' ' ' PHE . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.498 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CE1' HG22 ' A' ' 13' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.421 ' O ' ' CB ' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.432 ' CB ' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.432 HG22 ' CB ' ' A' ' 23' ' ' ARG . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.458 ' HA ' ' CD1' ' A' ' 37' ' ' LEU . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' O ' ' N ' ' A' ' 48' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.476 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.438 ' CG1' ' O ' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.432 ' O ' ' CG2' ' A' ' 52' ' ' VAL . 14.1 p . . . . . 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.417 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.998 0.428 . . . . 0.0 111.592 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.423 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.507 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.473 ' CD2' ' O ' ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.41 ' CG2' ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 36' ' ' ASP . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.469 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.473 ' O ' ' CD2' ' A' ' 16' ' ' TYR . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.443 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' CD ' ' HA ' ' A' ' 42' ' ' TYR . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.429 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.434 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.4 ' CB ' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.431 ' N ' ' O ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 64.9 m . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.483 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.471 HG21 ' CE1' ' A' ' 17' ' ' PHE . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CE1' HG21 ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.432 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 29' ' ' ASP . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.495 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.432 HG21 ' CB ' ' A' ' 23' ' ' ARG . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.445 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.436 ' CB ' HD11 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.435 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.483 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 8.1 p . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.692 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.428 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 17' ' ' PHE . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.485 ' CG ' ' O ' ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CE1' HG21 ' A' ' 13' ' ' VAL . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.435 ' HB3' ' CG1' ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.503 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.434 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.408 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.435 ' CG1' ' HB3' ' A' ' 19' ' ' GLU . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.481 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.485 ' O ' ' CG ' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.456 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.424 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.424 ' NE ' ' HA ' ' A' ' 43' ' ' CYS . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.471 ' CE ' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.441 ' CA ' ' HB ' ' A' ' 52' ' ' VAL . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.481 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 8.3 t-160 -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 71.5 m . . . . . 0 C--O 1.226 -0.175 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.535 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.421 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.513 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.43 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.459 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' CD2' ' CD1' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.429 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.401 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.443 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.442 ' CD1' ' CD2' ' A' ' 39' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.459 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.483 HG11 ' CZ ' ' A' ' 20' ' ' TYR . 12.2 p . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.409 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.475 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.494 HG22 ' CE1' ' A' ' 17' ' ' PHE . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.494 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.401 ' O ' ' HB1' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.462 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.462 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.439 HG21 ' CB ' ' A' ' 23' ' ' ARG . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.473 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.438 HD12 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.475 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.473 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.431 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 14.9 p . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 6.9 m . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.485 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.414 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.414 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.499 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.488 HD11 ' CD ' ' A' ' 45' ' ' ARG . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' CB ' ' CZ ' ' A' ' 45' ' ' ARG . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.436 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.497 ' CZ ' ' CB ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.434 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.48 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.482 HG13 ' CZ ' ' A' ' 20' ' ' TYR . 14.7 p . . . . . 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 44' ' ' CYS . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.93 0.395 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.481 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.496 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.481 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.44 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.473 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.496 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.518 ' CB ' ' NH1' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.478 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.518 ' NH1' ' CB ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.422 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.422 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CZ ' ' A' ' 17' ' ' PHE . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.473 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.481 HG12 ' CE1' ' A' ' 20' ' ' TYR . 9.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 121.015 0.436 . . . . 0.0 111.444 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.492 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.492 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.49 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.49 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 36' ' ' ASP . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.45 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.438 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.423 ' CE ' HD12 ' A' ' 7' ' ' LEU . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 39' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.477 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.411 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.445 HG12 ' CE1' ' A' ' 20' ' ' TYR . 9.5 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.986 0.422 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.436 HD13 ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.486 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.479 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.486 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.423 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.423 HG21 ' CB ' ' A' ' 23' ' ' ARG . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.48 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.417 ' N ' HD12 ' A' ' 39' ' ' LEU . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.451 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 45' ' ' ARG . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.48 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.4 ' O ' HG11 ' A' ' 52' ' ' VAL . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.432 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 12.6 p . . . . . 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.41 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.879 0.371 . . . . 0.0 111.314 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.423 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.487 HG22 ' CE1' ' A' ' 17' ' ' PHE . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' ASP . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.447 ' CD2' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.447 HD13 ' CD2' ' A' ' 39' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.477 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.444 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.444 ' CG1' ' O ' ' A' ' 51' ' ' HIS . 9.9 p . . . . . 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.4 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 CA-C-O 120.906 0.384 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.497 HG23 ' CE1' ' A' ' 17' ' ' PHE . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.499 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.497 ' CE1' HG23 ' A' ' 13' ' ' VAL . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.404 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.46 HG23 ' CG ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.489 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 36' ' ' ASP . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.488 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 48' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.415 ' CE ' HD13 ' A' ' 7' ' ' LEU . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.471 ' CD1' ' CD2' ' A' ' 39' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.488 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.441 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 6.5 p . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.403 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 120.945 0.402 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.433 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.495 HG23 ' CE1' ' A' ' 17' ' ' PHE . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.494 ' CG ' ' O ' ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.528 ' CE2' ' CG2' ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HB3' ' CG1' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.415 ' CG2' ' O ' ' A' ' 20' ' ' TYR . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.48 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.426 ' CG1' ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.472 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.494 ' O ' ' CG ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.446 ' CD2' HD11 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.452 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' N ' ' O ' ' A' ' 45' ' ' ARG . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.422 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.528 ' CG2' ' CE2' ' A' ' 17' ' ' PHE . 11.7 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.416 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.944 0.402 . . . . 0.0 111.612 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.452 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.495 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.495 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.494 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 36' ' ' ASP . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.457 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.44 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.439 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.439 ' CD ' ' HA ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.452 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.476 HG12 ' CZ ' ' A' ' 20' ' ' TYR . 8.0 p . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.415 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.055 0.455 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.436 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' CE1' ' A' ' 17' ' ' PHE . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.49 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.43 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.462 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 45' ' ' ARG . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 6.4 p . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.423 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.479 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.479 HG23 ' CE1' ' A' ' 17' ' ' PHE . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.479 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.406 ' HD3' ' NH1' ' A' ' 23' ' ' ARG . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.462 HG22 ' CG ' ' A' ' 20' ' ' TYR . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.489 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.416 ' N ' ' O ' ' A' ' 30' ' ' PRO . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.481 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.465 ' CD1' ' HB2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.41 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.479 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.481 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.446 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 9.7 p . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 ppp? . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.969 0.414 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.435 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 1.8 mp -59.91 137.3 90.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.151 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' O ' ' N ' ' A' ' 5' ' ' ARG . 48.5 Cg_endo -79.16 177.74 8.29 Favored 'Trans proline' 0 CA--C 1.515 -0.435 0 C-N-CA 122.658 2.239 . . . . 0.0 111.125 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.452 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.18 -76.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.808 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.452 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.8 OUTLIER -53.26 -178.73 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.745 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.408 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -103.79 100.01 9.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.326 -179.508 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.422 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.499 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.49 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.499 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.406 ' CB ' ' HB2' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.406 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.411 ' N ' ' O ' ' A' ' 30' ' ' PRO . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.47 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.49 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.432 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.427 ' HE3' ' CG ' ' A' ' 5' ' ' ARG . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.463 ' CA ' ' HB ' ' A' ' 52' ' ' VAL . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.47 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.463 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 10.6 p 34.93 56.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -51.18 90.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.424 ' N ' ' O ' ' A' ' 52' ' ' VAL . 6.4 p -76.54 -29.78 56.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.068 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.899 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.437 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 3.2 ppp? . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.852 0.358 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.479 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.6 mp -106.82 126.28 30.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.615 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.443 ' O ' ' N ' ' A' ' 5' ' ' ARG . 69.4 Cg_endo -72.79 -174.74 1.6 Allowed 'Trans proline' 0 CA--C 1.513 -0.533 0 C-N-CA 122.6 2.2 . . . . 0.0 111.499 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.43 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 66.53 -67.88 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 120.95 0.405 . . . . 0.0 110.804 177.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 3' ' ' PRO . 0.3 OUTLIER -75.18 -168.3 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.76 -179.157 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -58.33 -157.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.8 176.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.473 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.475 HG22 ' CE1' ' A' ' 17' ' ' PHE . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.419 ' OG ' ' CG ' ' A' ' 1' ' ' MET . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.519 ' CZ ' ' CG1' ' A' ' 52' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.442 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.485 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.485 ' HB2' ' CD1' ' A' ' 42' ' ' TYR . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.463 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.473 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.519 ' CG1' ' CZ ' ' A' ' 20' ' ' TYR . 14.5 p 35.57 68.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -46.63 128.83 10.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.304 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.7 p -129.18 23.88 5.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.199 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.2 p-90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 179.926 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.943 0.401 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.45 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 3.0 mp -60.39 141.16 91.57 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 43.0 Cg_endo -74.95 158.1 42.6 Favored 'Trans proline' 0 CA--C 1.514 -0.525 0 C-N-CA 122.502 2.135 . . . . 0.0 110.211 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.7 t 60.69 159.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.133 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.13 -178.2 0.18 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.701 0.286 . . . . 0.0 110.705 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 44' ' ' CYS . 14.7 p -107.99 106.75 17.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.45 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.53 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.493 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.423 ' NE2' ' HB ' ' A' ' 54' ' ' THR . 5.7 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.426 ' CB ' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.493 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.426 HG22 ' CB ' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.483 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.444 ' CD2' HD13 ' A' ' 48' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.403 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.408 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.425 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 39' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.483 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.452 HG11 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -41.48 108.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.64 -39.46 5.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.124 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.423 ' HB ' ' NE2' ' A' ' 21' ' ' GLN . 24.4 p 53.29 80.59 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.993 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 42.3 t-105 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.884 -179.919 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.434 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 3.4 ppp? . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.552 0.215 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.463 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 8.7 mt -102.98 136.16 19.29 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.546 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.445 ' O ' ' N ' ' A' ' 5' ' ' ARG . 56.5 Cg_endo -77.25 172.39 16.11 Favored 'Trans proline' 0 CA--C 1.515 -0.458 0 C-N-CA 122.522 2.148 . . . . 0.0 110.836 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.46 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.45 -77.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.521 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.46 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -55.86 179.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.664 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 94.5 m -57.84 -164.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.0 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.461 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.461 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.475 HG23 ' CE1' ' A' ' 17' ' ' PHE . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.485 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.503 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.405 ' O ' ' N ' ' A' ' 36' ' ' ASP . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.485 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.47 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.4 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.437 ' O ' ' N ' ' A' ' 48' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.409 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.433 ' CE ' HD13 ' A' ' 7' ' ' LEU . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.455 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.468 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.496 ' CG1' ' CZ ' ' A' ' 20' ' ' TYR . 13.4 p 34.26 94.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -50.72 130.87 25.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.944 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.7 p -125.44 103.31 7.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.0 t90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.899 -179.921 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' A' ' 2' ' ' ILE . 3.5 ppp? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.441 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 3.1 mp -135.52 140.3 33.68 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.171 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.427 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 63.8 Cg_endo -76.28 176.84 9.55 Favored 'Trans proline' 0 CA--C 1.517 -0.353 0 C-N-CA 122.719 2.279 . . . . 0.0 111.239 178.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.98 -76.53 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.035 0.445 . . . . 0.0 110.987 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.45 ' CG ' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -55.4 -179.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.057 -178.405 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.421 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.3 98.72 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.473 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.476 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.48 HG22 ' CE1' ' A' ' 17' ' ' PHE . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.498 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.48 ' CE1' HG22 ' A' ' 13' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.421 ' O ' ' CB ' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.432 ' CB ' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.496 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.432 HG22 ' CB ' ' A' ' 23' ' ' ARG . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.458 ' HA ' ' CD1' ' A' ' 37' ' ' LEU . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.446 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' O ' ' N ' ' A' ' 48' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.45 ' CE ' ' CG ' ' A' ' 5' ' ' ARG . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.476 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.438 ' CG1' ' O ' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.432 ' O ' ' CG2' ' A' ' 52' ' ' VAL . 14.1 p 44.99 27.7 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 47.23 75.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.213 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -103.48 -44.1 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.187 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.972 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.432 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 9.0 ptm . . . . . 0 C--O 1.232 0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.482 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 2.0 mp -119.72 140.0 28.84 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.048 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.462 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 63.1 Cg_endo -69.17 157.67 60.68 Favored 'Trans proline' 0 CA--C 1.511 -0.641 0 C-N-CA 121.893 1.729 . . . . 0.0 109.586 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.409 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 2.5 t 60.93 161.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.208 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.409 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 2.1 tpp180 79.83 -161.12 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.805 0.336 . . . . 0.0 111.178 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.417 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -120.15 100.82 7.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.592 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.423 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.507 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.473 ' CD2' ' O ' ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.41 ' CG2' ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 36' ' ' ASP . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.469 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.473 ' O ' ' CD2' ' A' ' 16' ' ' TYR . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.443 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' CD ' ' HA ' ' A' ' 42' ' ' TYR . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.429 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.434 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.4 ' CB ' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.431 ' N ' ' O ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER -40.74 108.18 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.21 -33.08 7.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.767 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 p 55.82 26.81 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.045 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.854 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 2.1 ppp? . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.039 0.447 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.471 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 30.4 mt -97.37 137.68 21.14 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.221 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 84.3 Cg_endo -71.13 170.82 17.25 Favored 'Trans proline' 0 CA--C 1.515 -0.462 0 C-N-CA 122.184 1.923 . . . . 0.0 110.797 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.56 -75.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.948 177.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 3' ' ' PRO . 3.8 tpp180 -61.06 178.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.174 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 64.9 m -59.68 -153.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.279 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.483 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.471 HG21 ' CE1' ' A' ' 17' ' ' PHE . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.471 ' CE1' HG21 ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.432 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 29' ' ' ASP . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.495 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.432 HG21 ' CB ' ' A' ' 23' ' ' ARG . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.445 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.436 ' CB ' HD11 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.435 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.411 ' HE3' ' CG ' ' A' ' 5' ' ' ARG . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.483 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 8.1 p 35.55 97.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.0 -22.6 67.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.27 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.479 HG22 ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 50.02 77.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.11 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . 0.438 ' CE3' ' HA ' ' A' ' 55' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.91 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.456 ' CA ' ' HE1' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 110.691 -0.114 . . . . 0.0 110.691 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.485 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.3 mp 61.7 65.77 1.68 Allowed Pre-proline 0 N--CA 1.455 -0.217 0 CA-C-O 121.225 0.535 . . . . 0.0 109.86 -176.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.48 ' O ' ' CG2' ' A' ' 4' ' ' VAL . 14.0 Cg_endo -89.61 15.31 1.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.452 2.768 . . . . 0.0 112.209 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.48 ' CG2' ' O ' ' A' ' 3' ' ' PRO . 1.8 t 149.55 -26.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 124.317 1.011 . . . . 0.0 108.75 -174.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.428 ' CG ' ' HE3' ' A' ' 47' ' ' MET . 0.8 OUTLIER -130.81 139.35 50.18 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.377 -178.413 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -58.0 100.61 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.692 178.794 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 ' CD ' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.416 ' HB2' ' CD1' ' A' ' 2' ' ' ILE . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.476 HG21 ' CE1' ' A' ' 17' ' ' PHE . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.485 ' CG ' ' O ' ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.476 ' CE1' HG21 ' A' ' 13' ' ' VAL . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.435 ' HB3' ' CG1' ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.503 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.503 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.435 ' CG1' ' HB3' ' A' ' 19' ' ' GLU . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.481 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.485 ' O ' ' CG ' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.456 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.424 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.424 ' NE ' ' HA ' ' A' ' 43' ' ' CYS . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.471 ' CE ' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.441 ' CA ' ' HB ' ' A' ' 52' ' ' VAL . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.481 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 8.3 t-160 -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p 45.92 76.55 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.4 94.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.229 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.2 p -97.42 40.06 1.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.033 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.994 -179.923 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 9.3 ptm . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.707 0.289 . . . . 0.0 110.606 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.459 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 1.7 mp -64.95 142.42 98.64 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.492 ' O ' ' CG2' ' A' ' 4' ' ' VAL . 33.8 Cg_endo -79.69 52.32 4.25 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 C-N-CA 123.067 2.511 . . . . 0.0 112.001 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.492 ' CG2' ' O ' ' A' ' 3' ' ' PRO . 1.5 t 151.46 154.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 124.228 0.955 . . . . 0.0 109.026 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 78.08 -170.29 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.454 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 71.5 m -58.91 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.847 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.535 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.421 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.513 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.43 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' CD2' ' CD1' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.429 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.401 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.443 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.442 ' CD1' ' CD2' ' A' ' 39' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.459 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.483 HG11 ' CZ ' ' A' ' 20' ' ' TYR . 12.2 p 42.38 29.29 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 47.75 96.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.108 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.3 p -155.49 147.93 23.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.103 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.947 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 ptm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.955 0.407 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.478 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 2.1 mp -64.84 139.89 97.91 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.377 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.47 ' O ' ' CG2' ' A' ' 4' ' ' VAL . 19.4 Cg_endo -86.49 43.88 1.13 Allowed 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 123.344 2.696 . . . . 0.0 112.934 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.47 ' CG2' ' O ' ' A' ' 3' ' ' PRO . 1.5 t -170.6 -73.02 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.736 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.456 ' HB3' ' CD2' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -57.21 175.68 0.14 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.774 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.409 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.85 101.03 13.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.081 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.478 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.494 HG22 ' CE1' ' A' ' 17' ' ' PHE . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.494 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.401 ' O ' ' HB1' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.462 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.401 ' HB1' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.462 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.439 HG21 ' CB ' ' A' ' 23' ' ' ARG . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.473 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.438 HD12 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.475 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.473 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.431 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 14.9 p 37.85 71.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -45.74 112.35 0.46 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.322 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.5 p -114.28 37.77 3.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.166 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.941 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.441 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.68 0.276 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.488 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 6.1 mt -84.66 138.61 38.02 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 111.313 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.459 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 91.1 Cg_endo -72.29 178.89 5.54 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 122.744 2.296 . . . . 0.0 111.444 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.428 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.38 -73.43 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.981 0.42 . . . . 0.0 110.99 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 3' ' ' PRO . 0.3 OUTLIER -67.73 -173.36 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.442 0.639 . . . . 0.0 112.171 -178.511 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 6.9 m -57.17 -162.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.632 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.488 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.485 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.492 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.485 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.414 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.414 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.499 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.488 HD11 ' CD ' ' A' ' 45' ' ' ARG . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.492 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' CB ' ' CZ ' ' A' ' 45' ' ' ARG . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.436 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.497 ' CZ ' ' CB ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.434 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.48 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.482 HG13 ' CZ ' ' A' ' 20' ' ' TYR . 14.7 p 42.49 34.8 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 61.05 96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.82 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.0 p -157.02 111.63 2.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.125 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.878 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 121.294 0.568 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.447 ' CG2' ' HD2' ' A' ' 3' ' ' PRO . 74.5 mt -54.08 140.55 52.17 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.686 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.496 ' O ' ' CG2' ' A' ' 4' ' ' VAL . 27.6 Cg_endo -81.22 52.22 4.23 Favored 'Trans proline' 0 CA--C 1.514 -0.518 0 C-N-CA 122.962 2.442 . . . . 0.0 111.6 178.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.496 ' CG2' ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.91 167.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 124.254 0.971 . . . . 0.0 108.504 -174.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 81.3 -166.62 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.015 0.436 . . . . 0.0 111.175 -179.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -109.34 101.48 10.46 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.018 179.528 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.481 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.496 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.481 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.44 ' CG1' ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.473 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.496 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.518 ' CB ' ' NH1' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.441 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.478 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.518 ' NH1' ' CB ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.422 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.422 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CZ ' ' A' ' 17' ' ' PHE . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.473 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.481 HG12 ' CE1' ' A' ' 20' ' ' TYR . 9.6 p 44.98 28.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 108.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.3 p -153.19 129.25 10.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.858 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 1.4 ppp? . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.991 0.424 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.47 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.8 mp -112.92 139.3 22.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.387 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.44 ' O ' ' N ' ' A' ' 5' ' ' ARG . 80.0 Cg_endo -73.3 178.97 5.94 Favored 'Trans proline' 0 CA--C 1.515 -0.472 0 C-N-CA 122.495 2.13 . . . . 0.0 110.715 177.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.5 -77.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.978 177.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.3 OUTLIER -52.25 -172.06 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.763 -178.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -108.9 99.42 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.444 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.492 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.492 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.49 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.49 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 36' ' ' ASP . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.45 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.438 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.427 ' HE2' ' CG ' ' A' ' 5' ' ' ARG . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 39' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.477 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.411 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.445 HG12 ' CE1' ' A' ' 20' ' ' TYR . 9.5 p 46.08 29.42 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.2 -88.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.025 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 p 43.7 46.78 6.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.82 0.343 . . . . 0.0 111.585 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.058 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.413 ' N ' ' OG ' ' A' ' 14' ' ' SER . 6.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.845 0.355 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.469 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.4 mp -65.85 136.15 95.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.149 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.45 ' O ' ' N ' ' A' ' 5' ' ' ARG . 52.9 Cg_endo -78.03 177.83 8.31 Favored 'Trans proline' 0 CA--C 1.515 -0.434 0 C-N-CA 122.731 2.287 . . . . 0.0 111.015 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.458 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.0 -76.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.637 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.458 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 2.0 tpp180 -54.67 176.69 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.641 -179.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 103.25 13.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.994 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.436 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.486 ' CG2' ' CE1' ' A' ' 17' ' ' PHE . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.413 ' OG ' ' N ' ' A' ' 1' ' ' MET . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.479 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.486 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.423 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.423 HG21 ' CB ' ' A' ' 23' ' ' ARG . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.48 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.479 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.417 ' N ' HD12 ' A' ' 39' ' ' LEU . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.461 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.451 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.418 ' HE3' ' CG ' ' A' ' 5' ' ' ARG . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 45' ' ' ARG . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.48 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.4 ' O ' HG11 ' A' ' 52' ' ' VAL . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.432 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 12.6 p 37.37 94.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.37 103.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.023 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.4 p -100.42 -39.25 8.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.02 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.5 p-90 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.864 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 13.1 ptm . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.993 0.425 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.455 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 2.0 mp -127.15 132.4 24.3 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.37 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' O ' ' N ' ' A' ' 5' ' ' ARG . 95.2 Cg_endo -71.01 179.36 4.44 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.435 2.09 . . . . 0.0 110.458 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.453 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.68 -77.13 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.604 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -56.5 175.92 0.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.481 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.41 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -103.32 102.51 12.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.314 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.455 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.487 HG22 ' CE1' ' A' ' 17' ' ' PHE . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.486 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' ASP . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.486 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.447 ' CD2' HD13 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.401 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.442 ' HE3' ' CG ' ' A' ' 5' ' ' ARG . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.447 HD13 ' CD2' ' A' ' 39' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.477 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.444 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.444 ' CG1' ' O ' ' A' ' 51' ' ' HIS . 9.9 p 54.36 135.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -82.13 119.42 24.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.889 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.6 p -128.0 25.33 5.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 43.6 t-105 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.938 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 CA--C 1.523 -0.08 0 CA-C-O 120.72 0.295 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.457 ' HB ' ' CD2' ' A' ' 7' ' ' LEU . 2.0 mp -71.39 136.92 83.78 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.089 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' O ' ' N ' ' A' ' 5' ' ' ARG . 64.2 Cg_endo -74.74 178.75 6.75 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.571 2.181 . . . . 0.0 111.01 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.427 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.89 -76.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.571 177.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.47 ' CG ' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -63.11 161.79 12.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.408 -179.643 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.4 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -90.85 105.15 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.835 178.718 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.497 HG23 ' CE1' ' A' ' 17' ' ' PHE . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.499 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.497 ' CE1' HG23 ' A' ' 13' ' ' VAL . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.404 ' CB ' HG21 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.46 HG23 ' CG ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.489 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.409 ' O ' ' N ' ' A' ' 36' ' ' ASP . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.488 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.499 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.471 ' CD2' ' CD1' ' A' ' 48' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 48' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.47 ' CE ' ' CG ' ' A' ' 5' ' ' ARG . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.471 ' CD1' ' CD2' ' A' ' 39' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.488 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.441 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 6.5 p 43.58 95.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -58.11 117.34 4.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.935 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -112.12 -26.9 8.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.968 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.4 m0 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.138 -0.935 . . . . 0.0 110.979 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.421 ' N ' ' OG ' ' A' ' 14' ' ' SER . 3.2 ppp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.761 0.315 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.468 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.4 mp -69.96 133.21 88.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.068 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 5' ' ' ARG . 68.6 Cg_endo -74.11 179.35 5.85 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 122.545 2.164 . . . . 0.0 110.918 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.459 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.81 -76.96 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.136 0.493 . . . . 0.0 110.753 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.459 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -54.74 -174.09 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.403 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -113.23 98.42 7.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.098 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.457 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.495 HG23 ' CE1' ' A' ' 17' ' ' PHE . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.421 ' OG ' ' N ' ' A' ' 1' ' ' MET . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.494 ' CG ' ' O ' ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.528 ' CE2' ' CG2' ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HB3' ' CG1' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' CG2' ' O ' ' A' ' 20' ' ' TYR . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.48 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.426 ' CG1' ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.472 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.494 ' O ' ' CG ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.446 ' CD2' HD11 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.452 ' O ' ' CG1' ' A' ' 49' ' ' ILE . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.439 ' CE ' ' HG3' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' N ' ' O ' ' A' ' 45' ' ' ARG . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.422 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.528 ' CG2' ' CE2' ' A' ' 17' ' ' PHE . 11.7 p 45.42 33.7 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 70.63 -68.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.076 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 52.29 96.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.082 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.961 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.417 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 4.6 ptm . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.979 0.418 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.9 mp -77.59 141.06 64.54 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.309 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.45 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 42.3 Cg_endo -74.84 157.55 43.38 Favored 'Trans proline' 0 CA--C 1.513 -0.564 0 C-N-CA 122.265 1.977 . . . . 0.0 109.979 177.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.422 ' O ' ' CB ' ' A' ' 5' ' ' ARG . 2.9 t 60.75 160.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.279 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.432 ' CG ' ' HE3' ' A' ' 47' ' ' MET . 0.4 OUTLIER 80.0 -161.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.827 0.346 . . . . 0.0 111.034 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.416 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -117.94 94.31 4.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.612 -179.289 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.454 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.495 ' O ' ' CD1' ' A' ' 17' ' ' PHE . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.495 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.494 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 36' ' ' ASP . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.457 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.488 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.44 ' CD2' HD12 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.439 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.439 ' CD ' ' HA ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.432 ' HE3' ' CG ' ' A' ' 5' ' ' ARG . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.452 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.476 HG12 ' CZ ' ' A' ' 20' ' ' TYR . 8.0 p 40.47 33.04 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 66.52 -160.05 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.681 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 p 74.3 23.58 2.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.069 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 45.0 t-105 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.886 -179.974 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.402 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 3.4 ppp? . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.925 0.393 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.469 ' N ' ' CD1' ' A' ' 2' ' ' ILE . 1.7 mp -85.98 135.62 37.24 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.548 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 5' ' ' ARG . 57.2 Cg_endo -78.13 179.33 6.6 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 122.572 2.181 . . . . 0.0 110.974 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.454 ' CG1' ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.84 -76.77 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.208 0.528 . . . . 0.0 110.892 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.454 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -51.95 -175.64 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.918 -178.397 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.415 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -107.17 96.96 6.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.495 -178.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.438 ' CD2' ' HB ' ' A' ' 2' ' ' ILE . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' CE1' ' A' ' 17' ' ' PHE . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.49 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.492 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.43 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.492 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.462 ' CD1' ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.442 ' HE1' ' CG ' ' A' ' 5' ' ' ARG . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 45' ' ' ARG . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.479 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 6.4 p 32.68 100.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -63.69 -65.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.719 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.401 ' CG2' HG22 ' A' ' 52' ' ' VAL . 2.8 p 65.58 136.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.651 -178.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.916 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' HA ' ' CE2' ' A' ' 17' ' ' PHE . 8.6 ptm . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.972 0.415 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.454 ' CG2' ' HD2' ' A' ' 3' ' ' PRO . 6.0 mt -121.18 138.85 28.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.838 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.488 ' O ' ' CG2' ' A' ' 4' ' ' VAL . 30.0 Cg_endo -80.21 53.67 4.86 Favored 'Trans proline' 0 CA--C 1.513 -0.537 0 C-N-CA 123.095 2.53 . . . . 0.0 111.132 177.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.488 ' CG2' ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.79 168.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 O-C-N 124.286 0.992 . . . . 0.0 108.41 -173.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 80.3 -163.24 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 111.212 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.423 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -114.71 96.88 5.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.17 -179.851 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.479 ' CD1' ' CD2' ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.479 HG23 ' CE1' ' A' ' 17' ' ' PHE . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.479 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE2' ' HB3' ' A' ' 30' ' ' PRO . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.406 ' HD3' ' NH1' ' A' ' 23' ' ' ARG . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.462 HG22 ' CG ' ' A' ' 20' ' ' TYR . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.489 ' HB3' ' CE2' ' A' ' 20' ' ' TYR . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.416 ' N ' ' O ' ' A' ' 30' ' ' PRO . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.481 ' CD2' ' CG2' ' A' ' 49' ' ' ILE . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.491 ' HA ' ' CD1' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.465 ' CD1' ' HB2' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.41 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.479 ' CD2' ' CD1' ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.481 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.446 ' CG1' ' O ' ' A' ' 52' ' ' VAL . 9.7 p 36.74 98.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -47.66 101.03 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.267 -179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.8 p -157.76 96.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.99 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.94 -179.894 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.889 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.875 0.369 . . . . 0.0 111.326 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.976 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.792 HG11 HD23 ' A' ' 39' ' ' LEU . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.911 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.516 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.813 ' HA ' HG11 ' A' ' 33' ' ' VAL . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.431 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.791 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.791 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.813 HG11 ' HA ' ' A' ' 20' ' ' TYR . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.911 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.853 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.433 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.976 ' CD2' HD12 ' A' ' 7' ' ' LEU . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.616 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 52' ' ' VAL . 10.6 p . . . . . 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.777 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.8 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.96 HG11 HD23 ' A' ' 39' ' ' LEU . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.843 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.937 ' HA ' HG11 ' A' ' 33' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.937 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.863 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.96 HD23 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.496 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.863 ' HG2' HD12 ' A' ' 34' ' ' LEU . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.502 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.8 HD21 HD12 ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.589 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.692 ' O ' HD13 ' A' ' 7' ' ' LEU . 14.7 p . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.978 HD12 HD21 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.454 ' OG ' HG13 ' A' ' 13' ' ' VAL . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HD3' ' CD ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.742 HG11 HD23 ' A' ' 39' ' ' LEU . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.716 ' HB3' HD23 ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.7 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.409 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.668 ' HG2' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.817 HG22 ' HG3' ' A' ' 30' ' ' PRO . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.817 ' HG3' HG22 ' A' ' 24' ' ' VAL . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.668 HG22 ' HG2' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.88 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.757 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 37' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.418 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.88 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.978 HD21 HD12 ' A' ' 7' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.541 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.46 HG13 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.587 ' C ' HD13 ' A' ' 7' ' ' LEU . 94.5 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.892 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.487 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.811 HG11 HD23 ' A' ' 39' ' ' LEU . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.831 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.466 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' OE1' ' HD2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.858 ' HA ' HG11 ' A' ' 33' ' ' VAL . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.433 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG3' HG22 ' A' ' 24' ' ' VAL . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.858 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.81 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.928 ' CB ' HD11 ' A' ' 39' ' ' LEU . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.928 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.81 ' HG2' HD12 ' A' ' 34' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.435 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.892 HD21 HD12 ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.509 ' CG2' HD21 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.659 ' O ' HG13 ' A' ' 52' ' ' VAL . 13.4 p . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.881 0.372 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.005 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.403 ' HA ' HG13 ' A' ' 13' ' ' VAL . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.908 HG11 HD23 ' A' ' 39' ' ' LEU . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.885 ' HB3' HD23 ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.819 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.453 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.825 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.825 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.819 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.928 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.885 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.908 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.461 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.928 ' HG2' HD12 ' A' ' 34' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.005 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.44 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.469 ' O ' HG12 ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.677 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.1 p . . . . . 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.626 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.998 0.428 . . . . 0.0 111.592 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.021 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.43 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.543 HG11 HD23 ' A' ' 39' ' ' LEU . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.72 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.541 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.746 ' HA ' HG11 ' A' ' 33' ' ' VAL . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.754 ' HG3' HG22 ' A' ' 24' ' ' VAL . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.746 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.758 ' HB2' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.453 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.752 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.419 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.021 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.435 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.772 ' O ' HD22 ' A' ' 7' ' ' LEU . 64.9 m . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.057 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.479 HG11 HD23 ' A' ' 39' ' ' LEU . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.815 ' HB3' HD23 ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.457 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.829 ' HA ' HG11 ' A' ' 33' ' ' VAL . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.812 HG22 ' HG3' ' A' ' 30' ' ' PRO . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.403 ' OE1' ' HB2' ' A' ' 26' ' ' ASP . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.812 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.83 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.858 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.858 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.46 ' C ' HD12 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.83 ' HG2' HD12 ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.057 HD21 HD12 ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 8.1 p . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.688 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.692 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.899 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.783 ' CG1' HD23 ' A' ' 39' ' ' LEU . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.766 ' HB3' HD23 ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.702 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.721 ' N ' HG11 ' A' ' 33' ' ' VAL . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.722 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.722 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.721 HG11 ' N ' ' A' ' 20' ' ' TYR . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.433 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.677 ' HA ' HD11 ' A' ' 49' ' ' ILE . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.511 ' HE1' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.899 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.694 ' O ' HD22 ' A' ' 7' ' ' LEU . 71.5 m . . . . . 0 C--O 1.226 -0.175 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.052 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.911 HG11 HD23 ' A' ' 39' ' ' LEU . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.904 ' HB3' HD23 ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.602 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.888 ' HA ' HG11 ' A' ' 33' ' ' VAL . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.536 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.749 HG21 ' CZ ' ' A' ' 20' ' ' TYR . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.43 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.738 ' HG3' HG22 ' A' ' 24' ' ' VAL . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.888 HG11 ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.79 HD12 ' CG ' ' A' ' 45' ' ' ARG . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.904 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.911 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.455 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.79 ' CG ' HD12 ' A' ' 34' ' ' LEU . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.407 ' HD2' ' HG3' ' A' ' 47' ' ' MET . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.052 HD21 HD12 ' A' ' 7' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' VAL . 12.2 p . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.095 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.718 HG11 HD23 ' A' ' 39' ' ' LEU . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.817 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.795 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 20' ' ' TYR . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.653 ' HG3' HG22 ' A' ' 24' ' ' VAL . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.795 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.9 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.817 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.9 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.095 HD21 HD12 ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.574 HG23 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.6 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.9 p . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.79 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.9 m . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 1.025 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.962 ' HB3' HD23 ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.534 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.926 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.725 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.725 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.926 HG11 ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.713 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.962 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.025 HD23 HG11 ' A' ' 13' ' ' VAL . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.448 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.923 ' HD2' HD13 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HD3' ' HG3' ' A' ' 47' ' ' MET . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.45 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.767 HD21 HD12 ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.657 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' VAL . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.7 p . . . . . 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.962 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.93 0.395 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.979 HD12 HD21 ' A' ' 48' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.428 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.891 HG12 HD23 ' A' ' 39' ' ' LEU . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.954 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.907 ' HA ' HG11 ' A' ' 33' ' ' VAL . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.741 HG22 ' HG3' ' A' ' 30' ' ' PRO . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.741 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.907 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.892 HD12 ' HG3' ' A' ' 45' ' ' ARG . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.48 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.892 ' HG3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.443 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.443 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.979 HD21 HD12 ' A' ' 7' ' ' LEU . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.56 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.518 ' O ' HG12 ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 52' ' ' VAL . 9.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 121.015 0.436 . . . . 0.0 111.444 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 13' ' ' VAL . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.744 ' CG1' HD23 ' A' ' 39' ' ' LEU . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.852 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.787 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.787 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.739 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.852 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.8 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HG2' HD12 ' A' ' 34' ' ' LEU . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 7' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.516 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.5 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.986 0.422 . . . . 0.0 110.994 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.048 HD12 HD21 ' A' ' 48' ' ' LEU . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.681 HG11 HD23 ' A' ' 39' ' ' LEU . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.801 ' HB3' HD23 ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.701 ' HA ' HG11 ' A' ' 33' ' ' VAL . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.632 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 30' ' ' PRO . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.416 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 26' ' ' ASP . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.794 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.915 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.915 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.411 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.774 ' CG ' HD12 ' A' ' 34' ' ' LEU . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.048 HD21 HD12 ' A' ' 7' ' ' LEU . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.662 ' O ' HG13 ' A' ' 52' ' ' VAL . 12.6 p . . . . . 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.886 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.879 0.371 . . . . 0.0 111.314 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.019 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.808 HG11 HD23 ' A' ' 39' ' ' LEU . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.841 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.846 ' HA ' HG11 ' A' ' 33' ' ' VAL . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.77 HG22 ' HG3' ' A' ' 30' ' ' PRO . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.77 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 20' ' ' TYR . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.75 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.841 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.75 ' CG ' HD12 ' A' ' 34' ' ' LEU . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 7' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.69 ' O ' HG12 ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.9 p . . . . . 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.896 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 CA-C-O 120.906 0.384 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.127 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.58 HG11 HD23 ' A' ' 39' ' ' LEU . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.804 ' HB3' HD23 ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.736 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.542 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.727 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.736 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.715 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.855 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.855 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HG2' HD12 ' A' ' 34' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.127 HD21 HD12 ' A' ' 7' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.57 HG23 HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.5 p . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.946 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 120.945 0.402 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.05 HD12 HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.616 HG11 HD23 ' A' ' 39' ' ' LEU . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.838 ' HB3' HD23 ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.568 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.704 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.681 ' N ' HG11 ' A' ' 33' ' ' VAL . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' HG3' ' A' ' 30' ' ' PRO . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 23' ' ' ARG . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.804 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.704 HG13 ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.781 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.838 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.781 ' HG2' HD12 ' A' ' 34' ' ' LEU . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.05 HD21 HD12 ' A' ' 7' ' ' LEU . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.612 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.516 ' O ' HG12 ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 52' ' ' VAL . 11.7 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.792 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.944 0.402 . . . . 0.0 111.612 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.981 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.852 HG11 HD23 ' A' ' 39' ' ' LEU . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.937 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.828 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.786 HG22 ' HG3' ' A' ' 30' ' ' PRO . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.786 ' HG3' HG22 ' A' ' 24' ' ' VAL . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.937 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.868 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.449 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.819 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.981 HD21 HD12 ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.561 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 8.0 p . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.912 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.055 0.455 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.004 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.451 ' HA ' HG13 ' A' ' 13' ' ' VAL . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.817 ' CG1' HD23 ' A' ' 39' ' ' LEU . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.907 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.9 tt0 -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HG2' HG22 ' A' ' 33' ' ' VAL . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.824 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.437 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.824 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.71 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.907 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.857 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.71 ' CG ' HD12 ' A' ' 34' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.004 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.563 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.661 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.4 p . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.976 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.855 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.873 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.412 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.708 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.548 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.712 HG22 ' HG3' ' A' ' 30' ' ' PRO . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.41 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.712 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.657 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.882 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.882 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.887 ' HG2' HD12 ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.503 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 9.7 p . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 ppp? . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.969 0.414 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.536 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.8 mp -59.91 137.3 90.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.151 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.488 ' HD2' HG23 ' A' ' 2' ' ' ILE . 48.5 Cg_endo -79.16 177.74 8.29 Favored 'Trans proline' 0 CA--C 1.515 -0.435 0 C-N-CA 122.658 2.239 . . . . 0.0 111.125 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.677 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.18 -76.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.808 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.677 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.8 OUTLIER -53.26 -178.73 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.745 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.889 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -103.79 100.01 9.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.326 -179.508 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.976 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.792 HG11 HD23 ' A' ' 39' ' ' LEU . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.911 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.516 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.813 ' HA ' HG11 ' A' ' 33' ' ' VAL . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.431 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.791 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.791 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.813 HG11 ' HA ' ' A' ' 20' ' ' TYR . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.911 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.853 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.482 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.976 ' CD2' HD12 ' A' ' 7' ' ' LEU . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.616 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 52' ' ' VAL . 10.6 p 34.93 56.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -51.18 90.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.424 ' N ' ' O ' ' A' ' 52' ' ' VAL . 6.4 p -76.54 -29.78 56.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.068 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.899 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.532 ' C ' HD12 ' A' ' 2' ' ' ILE . 3.2 ppp? . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.852 0.358 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.734 ' HB ' HD23 ' A' ' 7' ' ' LEU . 1.6 mp -106.82 126.28 30.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.615 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.451 ' O ' ' HB ' ' A' ' 4' ' ' VAL . 69.4 Cg_endo -72.79 -174.74 1.6 Allowed 'Trans proline' 0 CA--C 1.513 -0.533 0 C-N-CA 122.6 2.2 . . . . 0.0 111.499 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.499 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 66.53 -67.88 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 120.95 0.405 . . . . 0.0 110.804 177.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -75.18 -168.3 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.76 -179.157 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.777 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -58.33 -157.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.8 176.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.8 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.96 HG11 HD23 ' A' ' 39' ' ' LEU . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.419 ' OG ' ' CG ' ' A' ' 1' ' ' MET . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.843 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.937 ' HA ' HG11 ' A' ' 33' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.937 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.863 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.96 HD23 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.496 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.863 ' HG2' HD12 ' A' ' 34' ' ' LEU . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.502 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.8 HD21 HD12 ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' THR . 14.5 p 35.57 68.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -46.63 128.83 10.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.304 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 52' ' ' VAL . 64.7 p -129.18 23.88 5.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.199 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.2 p-90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 179.926 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.943 0.401 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.702 HG23 ' HD2' ' A' ' 3' ' ' PRO . 3.0 mp -60.39 141.16 91.57 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.702 ' HD2' HG23 ' A' ' 2' ' ' ILE . 43.0 Cg_endo -74.95 158.1 42.6 Favored 'Trans proline' 0 CA--C 1.514 -0.525 0 C-N-CA 122.502 2.135 . . . . 0.0 110.211 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.419 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.7 t 60.69 159.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.133 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.413 ' HG2' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 74.13 -178.2 0.18 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.701 0.286 . . . . 0.0 110.705 -179.678 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.692 ' O ' HD13 ' A' ' 7' ' ' LEU . 14.7 p -107.99 106.75 17.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.978 HD12 HD21 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.454 ' OG ' HG13 ' A' ' 13' ' ' VAL . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HD3' ' CD ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.742 HG11 HD23 ' A' ' 39' ' ' LEU . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.716 ' HB3' HD23 ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 8.4 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.409 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.668 ' HG2' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.817 HG22 ' HG3' ' A' ' 30' ' ' PRO . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.817 ' HG3' HG22 ' A' ' 24' ' ' VAL . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.668 HG22 ' HG2' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.88 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.757 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 37' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.418 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.88 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HG2' ' A' ' 5' ' ' ARG . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.978 HD21 HD12 ' A' ' 7' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.541 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.46 HG13 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -41.48 108.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.64 -39.46 5.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.124 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.4 p 53.29 80.59 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.993 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 42.3 t-105 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.884 -179.919 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.434 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 3.4 ppp? . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.552 0.215 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.685 HD12 HD21 ' A' ' 7' ' ' LEU . 8.7 mt -102.98 136.16 19.29 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.546 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.445 ' O ' ' N ' ' A' ' 5' ' ' ARG . 56.5 Cg_endo -77.25 172.39 16.11 Favored 'Trans proline' 0 CA--C 1.515 -0.458 0 C-N-CA 122.522 2.148 . . . . 0.0 110.836 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.694 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.45 -77.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.521 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.694 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -55.86 179.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.664 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.587 ' C ' HD13 ' A' ' 7' ' ' LEU . 94.5 m -57.84 -164.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.0 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.892 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.487 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.811 HG11 HD23 ' A' ' 39' ' ' LEU . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.831 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.466 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' OE1' ' HD2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.858 ' HA ' HG11 ' A' ' 33' ' ' VAL . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.433 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG3' HG22 ' A' ' 24' ' ' VAL . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.858 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.81 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.928 ' CB ' HD11 ' A' ' 39' ' ' LEU . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.928 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.81 ' HG2' HD12 ' A' ' 34' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.435 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.892 HD21 HD12 ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.509 ' CG2' HD21 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.659 ' O ' HG13 ' A' ' 52' ' ' VAL . 13.4 p 34.26 94.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -50.72 130.87 25.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.944 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 20' ' ' TYR . 43.7 p -125.44 103.31 7.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.0 t90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.899 -179.921 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.873 ' C ' HD12 ' A' ' 2' ' ' ILE . 3.5 ppp? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.873 HD12 ' C ' ' A' ' 1' ' ' MET . 3.1 mp -135.52 140.3 33.68 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.171 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.647 ' HD2' HG23 ' A' ' 2' ' ' ILE . 63.8 Cg_endo -76.28 176.84 9.55 Favored 'Trans proline' 0 CA--C 1.517 -0.353 0 C-N-CA 122.719 2.279 . . . . 0.0 111.239 178.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.672 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.98 -76.53 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.035 0.445 . . . . 0.0 110.987 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.672 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -55.4 -179.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.057 -178.405 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.3 98.72 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.473 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.005 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.403 ' HA ' HG13 ' A' ' 13' ' ' VAL . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.908 HG11 HD23 ' A' ' 39' ' ' LEU . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.885 ' HB3' HD23 ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.819 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.453 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.825 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.825 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.819 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.928 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.885 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.908 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.461 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.928 ' HG2' HD12 ' A' ' 34' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.669 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.005 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.44 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.469 ' O ' HG12 ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.677 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.1 p 44.99 27.7 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.56 ' OE1' HD11 ' A' ' 2' ' ' ILE . 34.8 mt-10 47.23 75.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.213 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.569 HG23 HG13 ' A' ' 52' ' ' VAL . 0.9 OUTLIER -103.48 -44.1 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.187 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.972 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.702 ' C ' HD12 ' A' ' 2' ' ' ILE . 9.0 ptm . . . . . 0 C--O 1.232 0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.702 HD12 ' C ' ' A' ' 1' ' ' MET . 2.0 mp -119.72 140.0 28.84 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.048 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.613 ' HD2' HG23 ' A' ' 2' ' ' ILE . 63.1 Cg_endo -69.17 157.67 60.68 Favored 'Trans proline' 0 CA--C 1.511 -0.641 0 C-N-CA 121.893 1.729 . . . . 0.0 109.586 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.424 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.5 t 60.93 161.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.208 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.409 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 2.1 tpp180 79.83 -161.12 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.805 0.336 . . . . 0.0 111.178 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.626 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -120.15 100.82 7.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.592 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.021 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.43 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.543 HG11 HD23 ' A' ' 39' ' ' LEU . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.72 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.541 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.746 ' HA ' HG11 ' A' ' 33' ' ' VAL . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.754 ' HG3' HG22 ' A' ' 24' ' ' VAL . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.746 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.758 ' HB2' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.453 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.752 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.419 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.021 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.435 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER -40.74 108.18 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.21 -33.08 7.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.767 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 p 55.82 26.81 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.045 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.854 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.648 ' HE2' ' HB2' ' A' ' 7' ' ' LEU . 2.1 ppp? . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.039 0.447 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.668 ' HB ' HD23 ' A' ' 7' ' ' LEU . 30.4 mt -97.37 137.68 21.14 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.221 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 84.3 Cg_endo -71.13 170.82 17.25 Favored 'Trans proline' 0 CA--C 1.515 -0.462 0 C-N-CA 122.184 1.923 . . . . 0.0 110.797 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.635 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.56 -75.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.948 177.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.635 ' N ' HG12 ' A' ' 4' ' ' VAL . 3.8 tpp180 -61.06 178.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.174 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.772 ' O ' HD22 ' A' ' 7' ' ' LEU . 64.9 m -59.68 -153.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.279 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.057 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.479 HG11 HD23 ' A' ' 39' ' ' LEU . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.815 ' HB3' HD23 ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.457 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.829 ' HA ' HG11 ' A' ' 33' ' ' VAL . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.812 HG22 ' HG3' ' A' ' 30' ' ' PRO . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.403 ' OE1' ' HB2' ' A' ' 26' ' ' ASP . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.812 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.83 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.858 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.858 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.46 ' C ' HD12 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.83 ' HG2' HD12 ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.057 HD21 HD12 ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 8.1 p 35.55 97.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.0 -22.6 67.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.27 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.766 HG21 ' HD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 50.02 77.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.11 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TRP . . . . . 0.445 ' CE3' ' HA ' ' A' ' 55' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.91 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.73 ' HE2' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 110.691 -0.114 . . . . 0.0 110.691 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.3 mp 61.7 65.77 1.68 Allowed Pre-proline 0 N--CA 1.455 -0.217 0 CA-C-O 121.225 0.535 . . . . 0.0 109.86 -176.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.73 ' HD3' ' HE2' ' A' ' 1' ' ' MET . 14.0 Cg_endo -89.61 15.31 1.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.452 2.768 . . . . 0.0 112.209 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.8 t 149.55 -26.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 124.317 1.011 . . . . 0.0 108.75 -174.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.82 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.8 OUTLIER -130.81 139.35 50.18 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.377 -178.413 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.876 ' N ' ' HE1' ' A' ' 47' ' ' MET . 0.0 OUTLIER -58.0 100.61 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.692 178.794 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.899 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.537 ' CB ' HD11 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.783 ' CG1' HD23 ' A' ' 39' ' ' LEU . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.766 ' HB3' HD23 ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.702 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.721 ' N ' HG11 ' A' ' 33' ' ' VAL . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.722 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.722 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.721 HG11 ' N ' ' A' ' 20' ' ' TYR . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.433 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.677 ' HA ' HD11 ' A' ' 49' ' ' ILE . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.876 ' HE1' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.899 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 0.8 OUTLIER -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p 45.92 76.55 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.4 94.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.229 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.443 HG23 HG22 ' A' ' 52' ' ' VAL . 5.2 p -97.42 40.06 1.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.033 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.994 -179.923 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.43 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 9.3 ptm . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.707 0.289 . . . . 0.0 110.606 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.933 ' HB ' HD23 ' A' ' 7' ' ' LEU . 1.7 mp -64.95 142.42 98.64 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.708 ' HD2' HG23 ' A' ' 2' ' ' ILE . 33.8 Cg_endo -79.69 52.32 4.25 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 C-N-CA 123.067 2.511 . . . . 0.0 112.001 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 151.46 154.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 124.228 0.955 . . . . 0.0 109.026 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 78.08 -170.29 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.454 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.694 ' O ' HD22 ' A' ' 7' ' ' LEU . 71.5 m -58.91 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.847 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.052 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.911 HG11 HD23 ' A' ' 39' ' ' LEU . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.904 ' HB3' HD23 ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.602 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.888 ' HA ' HG11 ' A' ' 33' ' ' VAL . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.536 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.749 HG21 ' CZ ' ' A' ' 20' ' ' TYR . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.43 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.738 ' HG3' HG22 ' A' ' 24' ' ' VAL . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.888 HG11 ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.79 HD12 ' CG ' ' A' ' 45' ' ' ARG . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.904 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.911 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.455 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.79 ' CG ' HD12 ' A' ' 34' ' ' LEU . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.407 ' HD2' ' HG3' ' A' ' 47' ' ' MET . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.052 HD21 HD12 ' A' ' 7' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' VAL . 12.2 p 42.38 29.29 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 47.75 96.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.108 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.714 HG21 ' HE1' ' A' ' 20' ' ' TYR . 1.3 p -155.49 147.93 23.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.103 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.947 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 ptm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.955 0.407 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.616 ' HB ' HD23 ' A' ' 7' ' ' LEU . 2.1 mp -64.84 139.89 97.91 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.377 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.841 ' O ' HG23 ' A' ' 4' ' ' VAL . 19.4 Cg_endo -86.49 43.88 1.13 Allowed 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 123.344 2.696 . . . . 0.0 112.934 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t -170.6 -73.02 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.736 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.66 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -57.21 175.68 0.14 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.774 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.85 101.03 13.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.081 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.095 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.718 HG11 HD23 ' A' ' 39' ' ' LEU . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.817 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.795 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 20' ' ' TYR . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.653 ' HG3' HG22 ' A' ' 24' ' ' VAL . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.795 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.9 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.817 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.9 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.095 HD21 HD12 ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.574 HG23 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.6 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.9 p 37.85 71.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -45.74 112.35 0.46 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.322 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.5 p -114.28 37.77 3.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.166 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.941 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.457 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.68 0.276 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.668 ' HB ' HD23 ' A' ' 7' ' ' LEU . 6.1 mt -84.66 138.61 38.02 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 111.313 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.64 ' HD2' HG23 ' A' ' 2' ' ' ILE . 91.1 Cg_endo -72.29 178.89 5.54 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 122.744 2.296 . . . . 0.0 111.444 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.587 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.38 -73.43 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.981 0.42 . . . . 0.0 110.99 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.587 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -67.73 -173.36 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.442 0.639 . . . . 0.0 112.171 -178.511 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.79 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.9 m -57.17 -162.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.632 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 1.025 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.962 ' HB3' HD23 ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.534 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.926 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.725 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.725 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.926 HG11 ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.713 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.962 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.025 HD23 HG11 ' A' ' 13' ' ' VAL . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.448 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.923 ' HD2' HD13 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HD3' ' HG3' ' A' ' 47' ' ' MET . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.45 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.767 HD21 HD12 ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.657 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' VAL . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.7 p 42.49 34.8 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.459 ' O ' HG23 ' A' ' 54' ' ' THR . 1.5 tt0 61.05 96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.82 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' GLU . 2.0 p -157.02 111.63 2.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.125 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.878 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.417 ' HE3' ' HB2' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 121.294 0.568 . . . . 0.0 111.42 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.61 HG23 ' HD2' ' A' ' 3' ' ' PRO . 74.5 mt -54.08 140.55 52.17 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.686 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.701 ' O ' HG23 ' A' ' 4' ' ' VAL . 27.6 Cg_endo -81.22 52.22 4.23 Favored 'Trans proline' 0 CA--C 1.514 -0.518 0 C-N-CA 122.962 2.442 . . . . 0.0 111.6 178.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.91 167.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 124.254 0.971 . . . . 0.0 108.504 -174.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 81.3 -166.62 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.015 0.436 . . . . 0.0 111.175 -179.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.962 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -109.34 101.48 10.46 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.018 179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.979 HD12 HD21 ' A' ' 48' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.428 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.891 HG12 HD23 ' A' ' 39' ' ' LEU . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.954 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.907 ' HA ' HG11 ' A' ' 33' ' ' VAL . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.741 HG22 ' HG3' ' A' ' 30' ' ' PRO . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.741 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.907 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.892 HD12 ' HG3' ' A' ' 45' ' ' ARG . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.48 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.892 ' HG3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.443 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.443 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.979 HD21 HD12 ' A' ' 7' ' ' LEU . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.56 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.518 ' O ' HG12 ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 52' ' ' VAL . 9.6 p 44.98 28.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 108.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.3 p -153.19 129.25 10.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.858 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.62 ' C ' HD12 ' A' ' 2' ' ' ILE . 1.4 ppp? . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.991 0.424 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.683 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.8 mp -112.92 139.3 22.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.387 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.625 ' HD2' HG23 ' A' ' 2' ' ' ILE . 80.0 Cg_endo -73.3 178.97 5.94 Favored 'Trans proline' 0 CA--C 1.515 -0.472 0 C-N-CA 122.495 2.13 . . . . 0.0 110.715 177.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.5 -77.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.978 177.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.703 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -52.25 -172.06 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.763 -178.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -108.9 99.42 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.444 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 13' ' ' VAL . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.744 ' CG1' HD23 ' A' ' 39' ' ' LEU . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.852 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.787 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.787 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.739 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.852 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.8 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HG2' HD12 ' A' ' 34' ' ' LEU . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.403 ' HE2' ' HB2' ' A' ' 47' ' ' MET . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 7' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.516 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.5 p 46.08 29.42 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.2 -88.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.025 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 p 43.7 46.78 6.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.82 0.343 . . . . 0.0 111.585 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.058 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.845 0.355 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.573 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.4 mp -65.85 136.15 95.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.149 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' A' ' 2' ' ' ILE . 52.9 Cg_endo -78.03 177.83 8.31 Favored 'Trans proline' 0 CA--C 1.515 -0.434 0 C-N-CA 122.731 2.287 . . . . 0.0 111.015 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.68 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.0 -76.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.637 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.68 ' N ' HG12 ' A' ' 4' ' ' VAL . 2.0 tpp180 -54.67 176.69 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.641 -179.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -103.85 103.25 13.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.994 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.048 HD12 HD21 ' A' ' 48' ' ' LEU . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.681 HG11 HD23 ' A' ' 39' ' ' LEU . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.801 ' HB3' HD23 ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.701 ' HA ' HG11 ' A' ' 33' ' ' VAL . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.632 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 30' ' ' PRO . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.416 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 26' ' ' ASP . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.794 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.915 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.915 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.411 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.774 ' CG ' HD12 ' A' ' 34' ' ' LEU . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.455 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.048 HD21 HD12 ' A' ' 7' ' ' LEU . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.662 ' O ' HG13 ' A' ' 52' ' ' VAL . 12.6 p 37.37 94.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.37 103.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.023 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.4 p -100.42 -39.25 8.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.02 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.5 p-90 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.864 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.864 ' C ' HD12 ' A' ' 2' ' ' ILE . 13.1 ptm . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.993 0.425 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.864 HD12 ' C ' ' A' ' 1' ' ' MET . 2.0 mp -127.15 132.4 24.3 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.37 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' O ' ' N ' ' A' ' 5' ' ' ARG . 95.2 Cg_endo -71.01 179.36 4.44 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.435 2.09 . . . . 0.0 110.458 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.68 -77.13 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.604 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.689 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -56.5 175.92 0.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.481 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.886 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -103.32 102.51 12.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.314 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.019 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.808 HG11 HD23 ' A' ' 39' ' ' LEU . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.841 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.846 ' HA ' HG11 ' A' ' 33' ' ' VAL . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.77 HG22 ' HG3' ' A' ' 30' ' ' PRO . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.77 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 20' ' ' TYR . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.75 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.841 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.75 ' CG ' HD12 ' A' ' 34' ' ' LEU . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 7' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.69 ' O ' HG12 ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.9 p 54.36 135.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -82.13 119.42 24.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.889 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.6 p -128.0 25.33 5.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 43.6 t-105 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.938 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 CA--C 1.523 -0.08 0 CA-C-O 120.72 0.295 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 2' ' ' ILE . 2.0 mp -71.39 136.92 83.78 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.089 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.558 ' HD2' HG23 ' A' ' 2' ' ' ILE . 64.2 Cg_endo -74.74 178.75 6.75 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.571 2.181 . . . . 0.0 111.01 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.65 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.89 -76.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.571 177.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.65 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -63.11 161.79 12.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.408 -179.643 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.896 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -90.85 105.15 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.835 178.718 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.127 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.58 HG11 HD23 ' A' ' 39' ' ' LEU . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.804 ' HB3' HD23 ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.736 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.542 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.727 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.736 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.715 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.855 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.855 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HG2' HD12 ' A' ' 34' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.47 ' CE ' ' CG ' ' A' ' 5' ' ' ARG . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.127 HD21 HD12 ' A' ' 7' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.57 HG23 HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.5 p 43.58 95.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -58.11 117.34 4.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.935 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -112.12 -26.9 8.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.968 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.4 m0 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.138 -0.935 . . . . 0.0 110.979 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ppp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.761 0.315 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.552 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.4 mp -69.96 133.21 88.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.068 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 5' ' ' ARG . 68.6 Cg_endo -74.11 179.35 5.85 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 122.545 2.164 . . . . 0.0 110.918 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.81 -76.96 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.136 0.493 . . . . 0.0 110.753 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.689 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -54.74 -174.09 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.946 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -113.23 98.42 7.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.098 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.05 HD12 HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.616 HG11 HD23 ' A' ' 39' ' ' LEU . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.838 ' HB3' HD23 ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.568 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.704 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.681 ' N ' HG11 ' A' ' 33' ' ' VAL . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' HG3' ' A' ' 30' ' ' PRO . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 23' ' ' ARG . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.804 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.704 HG13 ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.781 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.838 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.781 ' HG2' HD12 ' A' ' 34' ' ' LEU . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.479 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.05 HD21 HD12 ' A' ' 7' ' ' LEU . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.612 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.516 ' O ' HG12 ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 52' ' ' VAL . 11.7 p 45.42 33.7 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 70.63 -68.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.076 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.461 HG23 HG13 ' A' ' 52' ' ' VAL . 0.8 OUTLIER 52.29 96.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.082 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.961 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.417 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 4.6 ptm . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.979 0.418 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.676 HG23 ' HD2' ' A' ' 3' ' ' PRO . 1.9 mp -77.59 141.06 64.54 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.309 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.676 ' HD2' HG23 ' A' ' 2' ' ' ILE . 42.3 Cg_endo -74.84 157.55 43.38 Favored 'Trans proline' 0 CA--C 1.513 -0.564 0 C-N-CA 122.265 1.977 . . . . 0.0 109.979 177.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.9 t 60.75 160.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.279 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.4 OUTLIER 80.0 -161.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.827 0.346 . . . . 0.0 111.034 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.792 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -117.94 94.31 4.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.612 -179.289 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.981 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.852 HG11 HD23 ' A' ' 39' ' ' LEU . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.937 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.828 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.786 HG22 ' HG3' ' A' ' 30' ' ' PRO . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.786 ' HG3' HG22 ' A' ' 24' ' ' VAL . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.937 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.868 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.449 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.819 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.464 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.981 HD21 HD12 ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.561 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 8.0 p 40.47 33.04 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' C ' HG23 ' A' ' 54' ' ' THR . 0.7 OUTLIER 66.52 -160.05 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.681 -179.39 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.672 HG21 ' HE1' ' A' ' 20' ' ' TYR . 1.2 p 74.3 23.58 2.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.069 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 45.0 t-105 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.886 -179.974 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HE2' ' HB2' ' A' ' 7' ' ' LEU . 3.4 ppp? . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.925 0.393 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.657 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.7 mp -85.98 135.62 37.24 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.548 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.497 ' HD2' HG23 ' A' ' 2' ' ' ILE . 57.2 Cg_endo -78.13 179.33 6.6 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 122.572 2.181 . . . . 0.0 110.974 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.688 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.84 -76.77 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.208 0.528 . . . . 0.0 110.892 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.688 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -51.95 -175.64 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.918 -178.397 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.912 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -107.17 96.96 6.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.495 -178.841 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.004 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.451 ' HA ' HG13 ' A' ' 13' ' ' VAL . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.817 ' CG1' HD23 ' A' ' 39' ' ' LEU . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.907 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.9 tt0 -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HG2' HG22 ' A' ' 33' ' ' VAL . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.824 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.437 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.824 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.71 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.907 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.857 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.71 ' CG ' HD12 ' A' ' 34' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.541 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.004 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.563 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.661 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.4 p 32.68 100.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -63.69 -65.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.719 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.5 ' CG2' HG22 ' A' ' 52' ' ' VAL . 2.8 p 65.58 136.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.651 -178.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.916 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.473 ' HA ' ' CE2' ' A' ' 17' ' ' PHE . 8.6 ptm . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.972 0.415 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.741 HD12 HD21 ' A' ' 7' ' ' LEU . 6.0 mt -121.18 138.85 28.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.838 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.703 ' O ' HG23 ' A' ' 4' ' ' VAL . 30.0 Cg_endo -80.21 53.67 4.86 Favored 'Trans proline' 0 CA--C 1.513 -0.537 0 C-N-CA 123.095 2.53 . . . . 0.0 111.132 177.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.79 168.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 O-C-N 124.286 0.992 . . . . 0.0 108.41 -173.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 80.3 -163.24 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 111.212 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.976 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -114.71 96.88 5.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.17 -179.851 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.855 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.873 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 1' ' ' MET . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.548 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.712 HG22 ' HG3' ' A' ' 30' ' ' PRO . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.41 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.712 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.657 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.882 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.882 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.887 ' HG2' HD12 ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.412 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.503 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 9.7 p 36.74 98.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.66 101.03 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.267 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 53' ' ' GLU . 32.8 p -157.76 96.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.99 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.94 -179.894 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.889 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.875 0.369 . . . . 0.0 111.326 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.976 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.792 HG11 HD23 ' A' ' 39' ' ' LEU . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.911 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.516 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.813 ' HA ' HG11 ' A' ' 33' ' ' VAL . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.431 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.791 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.791 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.813 HG11 ' HA ' ' A' ' 20' ' ' TYR . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.911 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.853 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.433 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.976 ' CD2' HD12 ' A' ' 7' ' ' LEU . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.616 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 52' ' ' VAL . 10.6 p . . . . . 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.777 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.288 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.8 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.96 HG11 HD23 ' A' ' 39' ' ' LEU . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.843 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.937 ' HA ' HG11 ' A' ' 33' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.937 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.863 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.96 HD23 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.496 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.863 ' HG2' HD12 ' A' ' 34' ' ' LEU . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.502 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.8 HD21 HD12 ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.589 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.692 ' O ' HD13 ' A' ' 7' ' ' LEU . 14.7 p . . . . . 0 N--CA 1.454 -0.235 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.978 HD12 HD21 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.454 ' OG ' HG13 ' A' ' 13' ' ' VAL . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HD3' ' CD ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.742 HG11 HD23 ' A' ' 39' ' ' LEU . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.716 ' HB3' HD23 ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.7 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.409 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.668 ' HG2' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.817 HG22 ' HG3' ' A' ' 30' ' ' PRO . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.817 ' HG3' HG22 ' A' ' 24' ' ' VAL . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.668 HG22 ' HG2' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.88 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.757 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 37' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.418 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.88 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.978 HD21 HD12 ' A' ' 7' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.541 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.46 HG13 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.587 ' C ' HD13 ' A' ' 7' ' ' LEU . 94.5 m . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.892 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.487 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.811 HG11 HD23 ' A' ' 39' ' ' LEU . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.831 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.466 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' OE1' ' HD2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.858 ' HA ' HG11 ' A' ' 33' ' ' VAL . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.433 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG3' HG22 ' A' ' 24' ' ' VAL . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.858 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.81 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.928 ' CB ' HD11 ' A' ' 39' ' ' LEU . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.928 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.81 ' HG2' HD12 ' A' ' 34' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.435 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.892 HD21 HD12 ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.509 ' CG2' HD21 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.659 ' O ' HG13 ' A' ' 52' ' ' VAL . 13.4 p . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 CA-C-O 120.881 0.372 . . . . 0.0 111.473 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.005 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.403 ' HA ' HG13 ' A' ' 13' ' ' VAL . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.908 HG11 HD23 ' A' ' 39' ' ' LEU . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.885 ' HB3' HD23 ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.819 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.453 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.825 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.825 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.819 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.928 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.885 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.908 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.461 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.928 ' HG2' HD12 ' A' ' 34' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.005 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.44 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.469 ' O ' HG12 ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.677 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.1 p . . . . . 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.626 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.998 0.428 . . . . 0.0 111.592 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.021 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.43 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.543 HG11 HD23 ' A' ' 39' ' ' LEU . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.72 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.541 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.746 ' HA ' HG11 ' A' ' 33' ' ' VAL . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.754 ' HG3' HG22 ' A' ' 24' ' ' VAL . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.746 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.758 ' HB2' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.453 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.752 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.419 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.021 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.435 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.772 ' O ' HD22 ' A' ' 7' ' ' LEU . 64.9 m . . . . . 0 C--O 1.227 -0.127 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.057 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.479 HG11 HD23 ' A' ' 39' ' ' LEU . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.815 ' HB3' HD23 ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.457 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.829 ' HA ' HG11 ' A' ' 33' ' ' VAL . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.812 HG22 ' HG3' ' A' ' 30' ' ' PRO . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.403 ' OE1' ' HB2' ' A' ' 26' ' ' ASP . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.812 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.83 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.858 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.858 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.46 ' C ' HD12 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.83 ' HG2' HD12 ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.057 HD21 HD12 ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 8.1 p . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.688 ' C ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.692 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.899 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.783 ' CG1' HD23 ' A' ' 39' ' ' LEU . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.766 ' HB3' HD23 ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.702 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.721 ' N ' HG11 ' A' ' 33' ' ' VAL . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.722 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.722 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.721 HG11 ' N ' ' A' ' 20' ' ' TYR . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.433 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.677 ' HA ' HD11 ' A' ' 49' ' ' ILE . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.511 ' HE1' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.899 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 8.3 t-160 -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p . . . . . 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.694 ' O ' HD22 ' A' ' 7' ' ' LEU . 71.5 m . . . . . 0 C--O 1.226 -0.175 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.052 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.911 HG11 HD23 ' A' ' 39' ' ' LEU . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.904 ' HB3' HD23 ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.602 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.888 ' HA ' HG11 ' A' ' 33' ' ' VAL . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.536 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.749 HG21 ' CZ ' ' A' ' 20' ' ' TYR . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.43 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.738 ' HG3' HG22 ' A' ' 24' ' ' VAL . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.888 HG11 ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.79 HD12 ' CG ' ' A' ' 45' ' ' ARG . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.904 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.911 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.455 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.79 ' CG ' HD12 ' A' ' 34' ' ' LEU . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.407 ' HD2' ' HG3' ' A' ' 47' ' ' MET . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.052 HD21 HD12 ' A' ' 7' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' VAL . 12.2 p . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.095 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.718 HG11 HD23 ' A' ' 39' ' ' LEU . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.817 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.795 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 20' ' ' TYR . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.653 ' HG3' HG22 ' A' ' 24' ' ' VAL . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.795 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.9 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.817 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.9 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.095 HD21 HD12 ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.574 HG23 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.6 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.9 p . . . . . 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.79 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.9 m . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 1.025 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.962 ' HB3' HD23 ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.534 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.926 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.725 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.725 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.926 HG11 ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.713 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.962 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.025 HD23 HG11 ' A' ' 13' ' ' VAL . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.448 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.923 ' HD2' HD13 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HD3' ' HG3' ' A' ' 47' ' ' MET . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.45 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.767 HD21 HD12 ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.657 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' VAL . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.7 p . . . . . 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.962 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.301 0 CA-C-O 120.93 0.395 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.979 HD12 HD21 ' A' ' 48' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.428 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.891 HG12 HD23 ' A' ' 39' ' ' LEU . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.954 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.907 ' HA ' HG11 ' A' ' 33' ' ' VAL . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.741 HG22 ' HG3' ' A' ' 30' ' ' PRO . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.741 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.907 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.892 HD12 ' HG3' ' A' ' 45' ' ' ARG . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.48 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.892 ' HG3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.443 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.443 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.979 HD21 HD12 ' A' ' 7' ' ' LEU . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.56 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.518 ' O ' HG12 ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 52' ' ' VAL . 9.6 p . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.227 -0.119 0 CA-C-O 121.015 0.436 . . . . 0.0 111.444 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 13' ' ' VAL . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.744 ' CG1' HD23 ' A' ' 39' ' ' LEU . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.852 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.787 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.787 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.739 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.852 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.8 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HG2' HD12 ' A' ' 34' ' ' LEU . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 7' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.516 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.5 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.986 0.422 . . . . 0.0 110.994 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.048 HD12 HD21 ' A' ' 48' ' ' LEU . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.681 HG11 HD23 ' A' ' 39' ' ' LEU . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.801 ' HB3' HD23 ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.701 ' HA ' HG11 ' A' ' 33' ' ' VAL . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.632 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 30' ' ' PRO . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.416 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 26' ' ' ASP . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.794 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.774 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.915 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.915 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.411 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.774 ' CG ' HD12 ' A' ' 34' ' ' LEU . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.048 HD21 HD12 ' A' ' 7' ' ' LEU . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.662 ' O ' HG13 ' A' ' 52' ' ' VAL . 12.6 p . . . . . 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.886 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.879 0.371 . . . . 0.0 111.314 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.019 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.808 HG11 HD23 ' A' ' 39' ' ' LEU . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.841 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.846 ' HA ' HG11 ' A' ' 33' ' ' VAL . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.77 HG22 ' HG3' ' A' ' 30' ' ' PRO . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.77 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 20' ' ' TYR . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.75 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.841 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.75 ' CG ' HD12 ' A' ' 34' ' ' LEU . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 7' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.69 ' O ' HG12 ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.9 p . . . . . 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.896 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 CA-C-O 120.906 0.384 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.127 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.58 HG11 HD23 ' A' ' 39' ' ' LEU . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.804 ' HB3' HD23 ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.736 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.542 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.727 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.736 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.715 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.855 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.855 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HG2' HD12 ' A' ' 34' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.127 HD21 HD12 ' A' ' 7' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.57 HG23 HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.5 p . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.946 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 120.945 0.402 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.05 HD12 HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.616 HG11 HD23 ' A' ' 39' ' ' LEU . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.838 ' HB3' HD23 ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.568 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.704 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.681 ' N ' HG11 ' A' ' 33' ' ' VAL . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' HG3' ' A' ' 30' ' ' PRO . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 23' ' ' ARG . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.804 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.704 HG13 ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.781 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.838 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.781 ' HG2' HD12 ' A' ' 34' ' ' LEU . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.05 HD21 HD12 ' A' ' 7' ' ' LEU . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.612 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.516 ' O ' HG12 ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 52' ' ' VAL . 11.7 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.792 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.944 0.402 . . . . 0.0 111.612 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.981 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.852 HG11 HD23 ' A' ' 39' ' ' LEU . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.937 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.828 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.786 HG22 ' HG3' ' A' ' 30' ' ' PRO . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.786 ' HG3' HG22 ' A' ' 24' ' ' VAL . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.937 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.868 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.449 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.819 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.981 HD21 HD12 ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.561 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 8.0 p . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.912 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.055 0.455 . . . . 0.0 111.495 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.004 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.451 ' HA ' HG13 ' A' ' 13' ' ' VAL . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.817 ' CG1' HD23 ' A' ' 39' ' ' LEU . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.907 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HG2' HG22 ' A' ' 33' ' ' VAL . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.824 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.437 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.824 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.71 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.907 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.857 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.71 ' CG ' HD12 ' A' ' 34' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.004 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.563 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.661 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.4 p . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.976 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.855 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.873 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.412 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.708 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.548 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.712 HG22 ' HG3' ' A' ' 30' ' ' PRO . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.41 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.712 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.657 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.882 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.882 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.887 ' HG2' HD12 ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.503 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 9.7 p . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 ppp? . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.969 0.414 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.536 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.8 mp -59.91 137.3 90.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.151 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.488 ' HD2' HG23 ' A' ' 2' ' ' ILE . 48.5 Cg_endo -79.16 177.74 8.29 Favored 'Trans proline' 0 CA--C 1.515 -0.435 0 C-N-CA 122.658 2.239 . . . . 0.0 111.125 178.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.677 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.18 -76.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.808 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.677 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.8 OUTLIER -53.26 -178.73 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.745 -178.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.889 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -103.79 100.01 9.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.326 -179.508 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.976 HD12 ' CD2' ' A' ' 48' ' ' LEU . 1.4 mm? -133.71 45.51 2.65 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 177.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.5 OUTLIER -179.4 -55.96 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.747 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.51 15.35 9.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.691 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 139.58 -32.32 2.24 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.389 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -118.72 136.44 24.18 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-O 120.598 0.237 . . . . 0.0 110.878 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 38.0 Cg_exo -57.26 137.31 81.12 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.484 2.123 . . . . 0.0 112.244 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.792 HG11 HD23 ' A' ' 39' ' ' LEU . 6.0 m -109.79 -15.63 9.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.301 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.78 -56.15 25.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.844 0.355 . . . . 0.0 111.118 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.23 -31.19 61.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.911 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.3 m-85 -87.28 -27.07 23.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.279 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.516 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -47.77 -28.08 2.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.825 0.345 . . . . 0.0 110.732 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -62.0 -39.54 92.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.245 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -51.65 68.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.259 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.813 ' HA ' HG11 ' A' ' 33' ' ' VAL . 22.5 t80 -53.62 -48.37 69.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.352 178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -56.84 -58.9 6.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.858 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -52.14 -51.48 57.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.001 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.431 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -60.8 -64.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.049 -179.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.791 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.3 t -48.99 -30.39 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.157 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.48 -57.02 11.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.918 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.17 -29.75 70.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.888 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.58 28.91 2.19 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.463 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.415 ' HB2' ' CB ' ' A' ' 23' ' ' ARG . 6.8 mt-10 -87.13 146.66 25.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.776 0.322 . . . . 0.0 110.915 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.72 107.62 0.96 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.791 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.2 Cg_exo -56.28 -44.14 49.25 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.215 1.943 . . . . 0.0 111.826 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.14 -36.95 32.09 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.057 0.456 . . . . 0.0 110.107 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -40.07 90.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 176.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.813 HG11 ' HA ' ' A' ' 20' ' ' TYR . 48.0 t -61.13 -43.72 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.857 177.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -48.96 -37.88 21.39 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.19 178.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.98 -38.21 90.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.832 177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -78.11 -44.15 26.95 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.59 178.638 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.911 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.3 mt -45.95 -43.62 14.16 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.849 179.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.3 56.16 3.28 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.736 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.853 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -111.41 93.97 4.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.872 0.368 . . . . 0.0 110.818 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -49.72 144.1 6.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.125 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 63.63 132.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -73.43 -14.72 61.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.474 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 16.1 p -47.81 -29.4 3.17 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.931 0.396 . . . . 0.0 110.739 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.9 m -87.07 -57.89 2.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.262 178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 2.4 mtm180 -46.97 -56.15 6.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.16 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD2' ' CG ' ' A' ' 47' ' ' MET . 0.0 OUTLIER -42.35 -34.19 0.76 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.861 0.362 . . . . 0.0 111.305 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.482 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 38.3 mtm -87.32 -36.33 17.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.328 178.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.976 ' CD2' HD12 ' A' ' 7' ' ' LEU . 8.3 mt -72.11 -69.72 0.38 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.878 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.616 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -41.47 -30.75 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-O 120.907 0.384 . . . . 0.0 111.502 -177.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -88.04 -63.93 1.23 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.025 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -87.66 -73.89 0.46 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.034 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 52' ' ' VAL . 10.6 p 34.93 56.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 122.935 0.494 . . . . 0.0 112.313 -178.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -51.18 90.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.923 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.424 ' N ' ' O ' ' A' ' 52' ' ' VAL . 6.4 p -76.54 -29.78 56.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.068 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m95 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.278 -0.867 . . . . 0.0 110.899 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.532 ' C ' HD12 ' A' ' 2' ' ' ILE . 3.2 ppp? . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.852 0.358 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.734 ' HB ' HD23 ' A' ' 7' ' ' LEU . 1.6 mp -106.82 126.28 30.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.615 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.451 ' O ' ' HB ' ' A' ' 4' ' ' VAL . 69.4 Cg_endo -72.79 -174.74 1.6 Allowed 'Trans proline' 0 CA--C 1.513 -0.533 0 C-N-CA 122.6 2.2 . . . . 0.0 111.499 179.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.499 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 66.53 -67.88 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-O 120.95 0.405 . . . . 0.0 110.804 177.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -75.18 -168.3 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.76 -179.157 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.777 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -58.33 -157.56 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.8 176.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.8 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 84.74 30.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.479 0.487 . . . . 0.0 110.917 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -174.83 -76.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.714 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.3 m 60.14 17.04 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.413 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.4 -20.35 8.39 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.58 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.13 122.56 31.05 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.52 0.2 . . . . 0.0 111.071 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.58 131.52 40.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.572 2.182 . . . . 0.0 112.349 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.96 HG11 HD23 ' A' ' 39' ' ' LEU . 15.3 m -114.06 -18.55 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.603 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.419 ' OG ' ' CG ' ' A' ' 1' ' ' MET . 0.7 OUTLIER -56.24 -45.12 80.11 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.399 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.69 -32.1 73.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.386 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.843 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.9 m-85 -84.91 -24.06 28.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.048 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -46.12 -30.67 2.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.933 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -60.49 -37.84 82.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.136 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.16 -50.46 71.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.209 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.937 ' HA ' HG11 ' A' ' 33' ' ' VAL . 16.6 t80 -52.76 -50.09 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.062 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -55.69 -67.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.527 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.7 ttt180 -43.67 -52.14 6.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.528 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -62.03 2.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.758 0.313 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.1 t -49.5 -27.13 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.921 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.49 -58.36 5.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.934 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.6 OUTLIER -62.88 -36.35 83.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.69 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.411 ' N ' ' OE1' ' A' ' 28' ' ' GLU . . . 123.46 34.6 0.75 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.894 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 2.6 mp0 -96.18 154.73 17.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.92 112.91 13.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.366 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.807 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.7 Cg_exo -51.92 -39.23 69.2 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.172 1.915 . . . . 0.0 112.046 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -37.67 28.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.054 0.454 . . . . 0.0 110.03 178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.98 -40.7 83.07 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 176.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.937 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -58.72 -45.34 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.839 177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.863 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -49.83 -39.41 38.73 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.243 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -60.57 -33.89 73.37 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.73 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -84.36 -41.83 16.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.654 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -47.48 -45.58 26.24 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.633 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.62 60.6 2.95 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.735 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.96 HD23 HG11 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -104.74 -24.85 12.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.881 0.372 . . . . 0.0 110.928 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mptt 64.97 150.88 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.362 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? 60.27 148.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.83 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.496 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 0.2 OUTLIER -97.3 24.11 6.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.985 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.3 p -87.02 -28.67 22.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.528 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.8 -59.18 2.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.856 178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.863 ' HG2' HD12 ' A' ' 34' ' ' LEU . 36.2 mtt180 -43.28 -54.31 4.67 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.083 -177.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 1.5 ptt180 -36.41 -43.75 0.4 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.911 0.386 . . . . 0.0 111.948 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.502 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -81.19 -39.77 24.94 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.57 178.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.8 HD21 HD12 ' A' ' 7' ' ' LEU . 7.1 mt -70.63 -70.14 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.099 -176.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -40.74 -29.41 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.82 -78.38 0.12 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.84 0.352 . . . . 0.0 110.992 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.463 ' CE1' ' O ' ' A' ' 47' ' ' MET . 5.4 p80 -88.86 -65.4 1.02 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.964 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' THR . 14.5 p 35.57 68.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 122.847 0.459 . . . . 0.0 112.044 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -46.63 128.83 10.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.304 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 52' ' ' VAL . 64.7 p -129.18 23.88 5.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.199 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.2 p-90 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.977 179.926 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.943 0.401 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.702 HG23 ' HD2' ' A' ' 3' ' ' PRO . 3.0 mp -60.39 141.16 91.57 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.703 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.702 ' HD2' HG23 ' A' ' 2' ' ' ILE . 43.0 Cg_endo -74.95 158.1 42.6 Favored 'Trans proline' 0 CA--C 1.514 -0.525 0 C-N-CA 122.502 2.135 . . . . 0.0 110.211 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.419 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.7 t 60.69 159.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 C-N-CA 119.509 -0.877 . . . . 0.0 109.133 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.413 ' HG2' ' CE ' ' A' ' 47' ' ' MET . 0.0 OUTLIER 74.13 -178.2 0.18 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.701 0.286 . . . . 0.0 110.705 -179.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.692 ' O ' HD13 ' A' ' 7' ' ' LEU . 14.7 p -107.99 106.75 17.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.436 0.636 . . . . 0.0 111.072 178.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.978 HD12 HD21 ' A' ' 48' ' ' LEU . 0.3 OUTLIER -128.95 39.09 3.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.559 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.454 ' OG ' HG13 ' A' ' 13' ' ' VAL . 3.1 m 177.64 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.286 -178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.62 27.56 4.07 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.381 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.99 -26.73 5.54 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.194 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HD3' ' CD ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -114.98 124.76 29.84 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.573 0.225 . . . . 0.0 110.779 -179.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -57.0 131.35 44.94 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.27 1.98 . . . . 0.0 112.075 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.742 HG11 HD23 ' A' ' 39' ' ' LEU . 6.3 m -106.74 -22.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.155 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -48.03 80.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.06 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.716 ' HB3' HD23 ' A' ' 37' ' ' LEU . 9.6 m-85 -87.23 -25.55 23.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.251 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CE1' ' CG2' ' A' ' 13' ' ' VAL . 3.9 m-30 -46.74 -28.17 1.43 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.054 0.454 . . . . 0.0 110.648 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -60.63 -41.53 95.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.117 178.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -50.22 74.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.813 178.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.632 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 21.9 t80 -54.93 -49.16 71.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.168 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.7 tt0 -56.78 -56.12 25.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.769 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.409 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 3.3 ttt85 -57.91 -52.37 65.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.781 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.668 ' HG2' HG22 ' A' ' 33' ' ' VAL . 1.6 mpt_? -58.83 -66.75 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.755 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.817 HG22 ' HG3' ' A' ' 30' ' ' PRO . 65.5 t -47.83 -30.71 2.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.954 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -64.45 -59.68 4.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.896 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.29 -24.9 67.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.919 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 112.99 31.1 2.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.54 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -93.19 144.4 25.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.98 0.419 . . . . 0.0 111.169 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -55.66 113.0 4.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.817 ' HG3' HG22 ' A' ' 24' ' ' VAL . 34.9 Cg_exo -59.12 -43.17 44.16 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.18 1.92 . . . . 0.0 111.736 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.94 -43.52 19.15 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.576 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.9 -41.83 99.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.538 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.668 HG22 ' HG2' ' A' ' 23' ' ' ARG . 57.5 t -58.03 -45.49 88.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.29 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.88 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.0 mm? -47.53 -43.89 25.3 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.505 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -57.05 -37.13 71.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.754 177.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.3 m-20 -78.87 -41.8 28.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.43 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.757 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -48.95 -36.14 16.71 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.624 178.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.89 63.9 3.9 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 37' ' ' LEU . 2.0 mp -99.94 26.25 6.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.893 0.378 . . . . 0.0 111.257 -179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.418 ' CD ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER 59.57 -80.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.072 178.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.8 mmt85 -102.91 171.79 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.141 0.496 . . . . 0.0 111.87 -177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HA ' ' HG3' ' A' ' 45' ' ' ARG . 6.5 t80 -90.72 -20.61 22.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.8 178.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 10.5 p -47.06 -27.98 1.54 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 121.06 0.457 . . . . 0.0 110.718 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 0.4 OUTLIER -87.18 -53.04 5.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.056 178.552 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.88 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.2 mtt180 -46.0 -56.67 5.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.958 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 43' ' ' CYS . 21.4 ptt180 -38.65 -39.37 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.844 0.354 . . . . 0.0 111.894 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.413 ' CE ' ' HG2' ' A' ' 5' ' ' ARG . 8.7 mtm -82.49 -37.42 25.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.546 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.978 HD21 HD12 ' A' ' 7' ' ' LEU . 5.4 mt -71.0 -67.23 0.52 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.606 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.541 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -45.66 -32.38 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.882 0.372 . . . . 0.0 111.21 -179.268 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.9 m -87.68 -57.66 2.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.534 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -78.43 -54.22 6.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.81 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.46 HG13 ' CE1' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -41.48 108.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 CA-C-O 121.158 0.504 . . . . 0.0 111.25 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -109.64 -39.46 5.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.124 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.423 ' HB ' ' NE2' ' A' ' 21' ' ' GLN . 24.4 p 53.29 80.59 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.993 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 42.3 t-105 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.884 -179.919 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.434 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 3.4 ppp? . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.552 0.215 . . . . 0.0 110.821 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.685 HD12 HD21 ' A' ' 7' ' ' LEU . 8.7 mt -102.98 136.16 19.29 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.546 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.445 ' O ' ' N ' ' A' ' 5' ' ' ARG . 56.5 Cg_endo -77.25 172.39 16.11 Favored 'Trans proline' 0 CA--C 1.515 -0.458 0 C-N-CA 122.522 2.148 . . . . 0.0 110.836 177.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.694 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.45 -77.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.521 177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.694 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -55.86 179.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.664 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.587 ' C ' HD13 ' A' ' 7' ' ' LEU . 94.5 m -57.84 -164.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.0 177.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.892 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 93.42 28.61 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.951 0.9 . . . . 0.0 110.212 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.5 m 173.69 -72.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 69.3 m 52.64 21.65 1.94 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.567 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 153.41 -32.54 0.77 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.562 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' CG ' ' HD2' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -141.22 175.19 3.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 120.887 0.375 . . . . 0.0 111.388 -179.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.487 ' HD2' ' CG ' ' A' ' 11' ' ' LYS . 95.5 Cg_endo -83.58 139.73 9.07 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.925 2.417 . . . . 0.0 112.872 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.811 HG11 HD23 ' A' ' 39' ' ' LEU . 17.6 m -115.42 -14.43 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.308 178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -63.77 -44.6 92.91 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.38 -31.4 71.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.991 0.424 . . . . 0.0 110.435 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.831 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -87.29 -25.83 23.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.98 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.466 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.1 m-30 -47.7 -34.74 8.64 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.772 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -56.09 -33.5 65.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.131 0.491 . . . . 0.0 109.995 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' OE1' ' HD2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -66.01 -52.3 50.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.06 178.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.858 ' HA ' HG11 ' A' ' 33' ' ' VAL . 12.5 t80 -54.9 -47.76 73.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.074 177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -63.12 -39.64 95.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.689 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 ttt85 -63.43 -53.62 49.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.884 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.433 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -60.58 -62.44 1.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.865 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.699 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.5 t -48.14 -31.42 3.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.168 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.73 -45.35 90.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.735 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -76.58 -34.36 58.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.884 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.39 33.23 1.14 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.716 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 6.3 mt-10 -95.05 166.93 11.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.88 0.372 . . . . 0.0 111.051 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -76.12 111.6 16.04 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.441 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.699 ' HG3' HG22 ' A' ' 24' ' ' VAL . 43.2 Cg_exo -55.08 -37.95 93.72 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.232 1.954 . . . . 0.0 112.01 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.1 -38.53 25.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.292 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.12 -39.51 82.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.433 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.858 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.7 t -58.54 -44.82 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.923 177.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.81 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.4 mm? -48.78 -47.44 41.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.495 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -56.29 -32.08 64.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.637 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -80.88 -45.21 17.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.291 178.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.928 ' CB ' HD11 ' A' ' 39' ' ' LEU . 1.1 mt -49.47 -54.66 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.537 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.75 52.13 1.13 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.923 -0.655 . . . . 0.0 113.004 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.928 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.18 69.32 1.4 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.964 0.411 . . . . 0.0 111.152 -179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 10.2 mmtm -54.69 -171.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.311 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 8.0 mtt85 84.29 -49.99 0.11 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 122.718 0.407 . . . . 0.0 111.508 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 4.3 t80 89.77 -23.92 0.09 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.022 0.529 . . . . 0.0 110.769 -178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 9.1 p -53.26 -30.74 40.02 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-O 121.217 0.532 . . . . 0.0 109.702 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.3 m -84.41 -59.48 2.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.421 178.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.81 ' HG2' HD12 ' A' ' 34' ' ' LEU . 39.0 mtt180 -44.24 -56.3 4.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.394 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.98 -34.84 1.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.002 0.43 . . . . 0.0 111.176 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.435 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 2.7 ttm -88.08 -29.32 20.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.892 HD21 HD12 ' A' ' 7' ' ' LEU . 6.2 mt -86.69 -67.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.161 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.509 ' CG2' HD21 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -39.66 -32.7 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -177.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.32 -64.52 1.14 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.148 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -87.32 -77.54 0.33 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.633 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.659 ' O ' HG13 ' A' ' 52' ' ' VAL . 13.4 p 34.26 94.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 122.92 0.488 . . . . 0.0 112.224 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -50.72 130.87 25.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.944 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.504 HG21 ' HE1' ' A' ' 20' ' ' TYR . 43.7 p -125.44 103.31 7.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.077 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.0 t90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.899 -179.921 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.873 ' C ' HD12 ' A' ' 2' ' ' ILE . 3.5 ppp? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.873 HD12 ' C ' ' A' ' 1' ' ' MET . 3.1 mp -135.52 140.3 33.68 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.171 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.647 ' HD2' HG23 ' A' ' 2' ' ' ILE . 63.8 Cg_endo -76.28 176.84 9.55 Favored 'Trans proline' 0 CA--C 1.517 -0.353 0 C-N-CA 122.719 2.279 . . . . 0.0 111.239 178.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.672 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.98 -76.53 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.035 0.445 . . . . 0.0 110.987 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.672 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -55.4 -179.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.057 -178.405 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -102.3 98.72 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.473 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.005 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -135.17 46.25 2.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.328 177.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.403 ' HA ' HG13 ' A' ' 13' ' ' VAL . 1.4 m -179.06 -60.18 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.894 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 62.73 22.71 13.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.236 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 130.96 -23.79 4.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.696 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.33 129.51 24.88 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.512 0.196 . . . . 0.0 111.03 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.43 127.73 25.81 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.444 2.096 . . . . 0.0 112.09 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.908 HG11 HD23 ' A' ' 39' ' ' LEU . 3.8 m -103.42 -4.24 9.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.702 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.5 m -63.2 -72.75 0.13 Allowed 'General case' 0 C--O 1.23 0.049 0 CA-C-O 120.846 0.355 . . . . 0.0 111.332 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.81 -25.17 1.18 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.552 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.885 ' HB3' HD23 ' A' ' 37' ' ' LEU . 19.0 m-85 -86.87 -26.07 24.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.637 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.01 -28.17 3.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.808 0.337 . . . . 0.0 110.608 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -62.84 -35.42 79.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.952 177.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.7 tt0 -61.44 -56.14 23.54 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.173 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.819 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.5 t80 -51.68 -48.05 63.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.397 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.4 tt0 -57.91 -58.03 10.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.632 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -52.52 -52.84 52.65 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.699 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.453 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.5 OUTLIER -62.49 -67.34 0.43 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.34 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.825 HG22 ' HG3' ' A' ' 30' ' ' PRO . 59.3 t -49.24 -26.26 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.973 0.416 . . . . 0.0 110.981 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.496 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -69.52 -49.07 58.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.997 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' CB ' ' OE1' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -71.55 -33.14 68.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.943 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.41 29.48 1.31 Allowed Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.826 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' OE1' ' CB ' ' A' ' 26' ' ' ASP . 3.8 mp0 -93.56 147.51 22.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.3 . . . . 0.0 110.945 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -55.67 109.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.602 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.825 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.0 Cg_exo -56.22 -43.56 54.97 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.186 1.924 . . . . 0.0 111.778 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.79 -39.28 24.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.13 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -64.55 -42.28 95.79 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.819 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.0 t -58.8 -44.03 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.138 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.928 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.33 -40.05 33.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.384 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -62.0 -34.6 76.48 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.996 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -82.24 -41.41 20.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.504 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.885 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.2 mt -47.58 -52.77 16.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.576 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.3 46.25 0.7 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.917 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.908 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -138.17 78.89 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.897 0.379 . . . . 0.0 110.598 -179.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.52 78.22 4.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.102 0.477 . . . . 0.0 111.352 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 6.8 mmp_? -148.54 -42.09 0.16 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.967 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.461 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.1 OUTLIER 89.91 -39.1 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.236 0.614 . . . . 0.0 111.058 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.9 p -54.12 -29.58 45.58 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.405 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.9 m -88.25 -52.98 4.93 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.209 175.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.928 ' HG2' HD12 ' A' ' 34' ' ' LEU . 1.5 mtp180 -46.6 -56.75 5.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.534 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.5 ptt180 -41.86 -37.13 1.2 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.872 0.368 . . . . 0.0 111.563 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.669 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 37.5 mtm -85.39 -27.97 25.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.936 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.005 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -86.98 -64.09 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.913 -178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.44 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.72 -28.89 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.754 0.312 . . . . 0.0 111.754 -178.031 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.2 m -86.88 -76.84 0.34 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.42 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.469 ' O ' HG12 ' A' ' 52' ' ' VAL . 15.1 t60 -87.43 -68.15 0.77 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.677 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.1 p 44.99 27.7 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.56 ' OE1' HD11 ' A' ' 2' ' ' ILE . 34.8 mt-10 47.23 75.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.213 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.569 HG23 HG13 ' A' ' 52' ' ' VAL . 0.9 OUTLIER -103.48 -44.1 5.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.187 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.972 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.702 ' C ' HD12 ' A' ' 2' ' ' ILE . 9.0 ptm . . . . . 0 C--O 1.232 0.159 0 CA-C-O 121.062 0.458 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.702 HD12 ' C ' ' A' ' 1' ' ' MET . 2.0 mp -119.72 140.0 28.84 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.048 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.613 ' HD2' HG23 ' A' ' 2' ' ' ILE . 63.1 Cg_endo -69.17 157.67 60.68 Favored 'Trans proline' 0 CA--C 1.511 -0.641 0 C-N-CA 121.893 1.729 . . . . 0.0 109.586 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.424 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.5 t 60.93 161.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.4 -0.92 . . . . 0.0 109.208 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.409 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 2.1 tpp180 79.83 -161.12 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.805 0.336 . . . . 0.0 111.178 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.626 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -120.15 100.82 7.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.592 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.021 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.06 38.72 3.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.336 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.43 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 17.1 m -172.64 -61.54 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.919 -178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.57 5.61 5.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.784 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.25 -40.48 0.45 Allowed Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.467 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -125.48 157.18 68.96 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.8 0.333 . . . . 0.0 111.365 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -64.67 138.43 58.79 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.705 2.27 . . . . 0.0 112.195 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.543 HG11 HD23 ' A' ' 39' ' ' LEU . 11.2 m -108.24 -23.95 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.153 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 m -55.57 -45.06 77.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.093 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.08 -33.38 75.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.112 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.72 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.2 m-85 -85.47 -24.88 27.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.094 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.541 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.3 m-30 -45.25 -28.91 0.87 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.74 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -43.83 97.34 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.097 178.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -53.9 -49.44 68.57 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.943 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.746 ' HA ' HG11 ' A' ' 33' ' ' VAL . 26.3 t80 -52.82 -48.71 66.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.141 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -59.79 -53.39 58.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.627 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtt85 -54.15 -52.61 60.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.808 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -65.68 0.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.754 HG22 ' HG3' ' A' ' 30' ' ' PRO . 64.5 t -48.24 -36.53 6.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.006 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.6 -54.18 44.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -70.65 -42.79 70.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.959 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.69 38.4 0.24 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.778 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -100.37 146.0 27.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.82 0.343 . . . . 0.0 111.118 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.72 112.01 5.85 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.447 179.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.754 ' HG3' HG22 ' A' ' 24' ' ' VAL . 51.1 Cg_exo -52.35 -37.22 71.29 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.234 1.956 . . . . 0.0 112.208 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.83 -41.57 33.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.458 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -39.27 86.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.58 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.746 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.1 t -60.25 -48.85 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.545 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -48.26 -43.69 32.8 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.905 0.383 . . . . 0.0 110.55 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -58.17 -33.39 69.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.798 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' VAL . 2.4 m-20 -82.8 -40.18 20.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.385 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.758 ' HB2' HD11 ' A' ' 39' ' ' LEU . 0.3 OUTLIER -49.84 -32.16 13.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.572 179.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.21 -47.01 1.1 Allowed Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.267 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.758 HD11 ' HB2' ' A' ' 37' ' ' LEU . 0.1 OUTLIER -41.26 109.89 0.14 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.951 0.405 . . . . 0.0 111.564 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -86.85 173.07 9.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 61.73 129.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.525 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.453 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 6.4 p90 -68.72 -20.67 64.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.47 -178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.8 p -46.33 -31.22 2.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.064 0.459 . . . . 0.0 110.545 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.3 m -88.03 -58.75 2.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.253 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.752 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -50.49 -54.6 21.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.052 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' CG ' ' O ' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -42.33 -34.33 0.78 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.991 0.424 . . . . 0.0 111.239 -179.459 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.419 ' CG ' ' HD2' ' A' ' 46' ' ' ARG . 11.7 mtm -87.36 -34.36 18.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.699 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.021 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -79.7 -68.98 0.62 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.813 -178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.469 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.2 pt -43.33 -34.17 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.867 0.365 . . . . 0.0 111.68 -178.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -87.46 -52.85 5.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.801 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 47' ' ' MET . 29.9 t60 -83.61 -54.5 4.89 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.435 ' HB ' ' CA ' ' A' ' 48' ' ' LEU . 0.5 OUTLIER -40.74 108.18 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.158 0.504 . . . . 0.0 111.289 -178.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -107.21 -33.08 7.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.767 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 p 55.82 26.81 10.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.045 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.854 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.648 ' HE2' ' HB2' ' A' ' 7' ' ' LEU . 2.1 ppp? . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.039 0.447 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.668 ' HB ' HD23 ' A' ' 7' ' ' LEU . 30.4 mt -97.37 137.68 21.14 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.221 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HD2' ' CG2' ' A' ' 2' ' ' ILE . 84.3 Cg_endo -71.13 170.82 17.25 Favored 'Trans proline' 0 CA--C 1.515 -0.462 0 C-N-CA 122.184 1.923 . . . . 0.0 110.797 178.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.635 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.56 -75.45 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.948 177.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.635 ' N ' HG12 ' A' ' 4' ' ' VAL . 3.8 tpp180 -61.06 178.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.923 -0.58 . . . . 0.0 112.174 -178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.772 ' O ' HD22 ' A' ' 7' ' ' LEU . 64.9 m -59.68 -153.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.279 178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.057 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 91.33 22.32 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.749 0.819 . . . . 0.0 110.616 -178.282 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 9' ' ' CYS . 79.4 p -175.74 -70.8 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.177 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' N ' ' OG ' ' A' ' 8' ' ' SER . 38.7 m 50.54 26.04 2.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.599 178.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.67 -7.69 15.45 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.451 -0.881 . . . . 0.0 113.461 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.97 161.46 63.62 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.993 0.397 . . . . 0.0 111.522 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -90.07 125.19 1.25 Allowed 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.056 2.504 . . . . 0.0 112.493 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.479 HG11 HD23 ' A' ' 39' ' ' LEU . 12.9 m -118.37 -17.08 7.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.799 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.21 -53.33 59.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.826 0.346 . . . . 0.0 111.243 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.92 -28.2 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.099 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.815 ' HB3' HD23 ' A' ' 37' ' ' LEU . 17.0 m-85 -87.35 -25.13 24.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.409 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.457 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.22 -27.64 1.58 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.935 0.398 . . . . 0.0 110.74 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -64.38 -40.34 95.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.046 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -54.17 -52.56 60.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.118 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.829 ' HA ' HG11 ' A' ' 33' ' ' VAL . 15.5 t80 -52.14 -49.3 64.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.228 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -57.19 -59.68 4.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.741 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -51.72 -49.36 62.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.702 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -62.14 -63.7 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.441 -179.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.812 HG22 ' HG3' ' A' ' 30' ' ' PRO . 66.0 t -48.11 -33.0 3.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.126 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -54.18 48.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.05 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HB2' ' OE1' ' A' ' 28' ' ' GLU . 88.5 m-20 -63.05 -40.79 98.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.07 31.93 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.925 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.403 ' OE1' ' HB2' ' A' ' 26' ' ' ASP . 2.7 mt-10 -95.63 153.22 17.83 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.719 0.295 . . . . 0.0 111.056 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.65 110.0 3.23 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.406 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.812 ' HG3' HG22 ' A' ' 24' ' ' VAL . 50.5 Cg_exo -52.1 -37.41 68.77 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.084 1.856 . . . . 0.0 111.581 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -49.62 -42.96 46.27 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.55 -44.18 97.51 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.0 t -57.17 -45.86 84.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.512 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.83 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.5 mm? -49.99 -38.36 36.84 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.954 0.407 . . . . 0.0 110.375 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -63.2 -33.78 76.21 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.724 178.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.7 m-20 -81.46 -42.52 20.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.858 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -47.83 -52.01 20.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.652 178.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.51 57.67 1.18 Allowed Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.6 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.858 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.93 96.12 5.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.793 0.33 . . . . 0.0 111.027 -179.485 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -55.46 153.43 7.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.064 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 61.44 138.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.4 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 8.1 p90 -77.65 -18.06 57.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.164 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 20.4 p -47.98 -27.39 2.19 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-O 121.031 0.443 . . . . 0.0 110.738 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.46 ' C ' HD12 ' A' ' 48' ' ' LEU . 1.8 m -87.04 -55.57 3.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.47 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.83 ' HG2' HD12 ' A' ' 34' ' ' LEU . 3.9 mtp180 -47.22 -54.92 9.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.243 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -39.09 -46.07 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.895 0.379 . . . . 0.0 111.73 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.1 mtm -80.18 -31.25 38.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.63 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.057 HD21 HD12 ' A' ' 7' ' ' LEU . 6.3 mt -79.5 -70.25 0.52 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.044 -178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.472 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -43.08 -30.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 120.797 0.332 . . . . 0.0 111.618 -177.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.84 -69.88 0.55 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.035 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -87.58 -77.36 0.34 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.726 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 8.1 p 35.55 97.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.377 0.608 . . . . 0.0 112.215 -178.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -64.0 -22.6 67.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.27 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.766 HG21 ' HD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER 50.02 77.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.11 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . 0.445 ' CE3' ' HA ' ' A' ' 55' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.91 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.73 ' HE2' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 110.691 -0.114 . . . . 0.0 110.691 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.711 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.3 mp 61.7 65.77 1.68 Allowed Pre-proline 0 N--CA 1.455 -0.217 0 CA-C-O 121.225 0.535 . . . . 0.0 109.86 -176.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.73 ' HD3' ' HE2' ' A' ' 1' ' ' MET . 14.0 Cg_endo -89.61 15.31 1.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.452 2.768 . . . . 0.0 112.209 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.8 t 149.55 -26.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 124.317 1.011 . . . . 0.0 108.75 -174.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.82 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.8 OUTLIER -130.81 139.35 50.18 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.377 -178.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.876 ' N ' ' HE1' ' A' ' 47' ' ' MET . 0.0 OUTLIER -58.0 100.61 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.692 178.794 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.899 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -126.17 37.04 4.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.269 -179.433 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.537 ' CB ' HD11 ' A' ' 2' ' ' ILE . 0.1 OUTLIER -173.32 -75.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.12 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 70.88 16.8 6.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.556 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 134.72 -30.08 2.9 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.031 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.7 121.07 28.4 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 46.4 Cg_exo -56.36 130.64 41.17 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.297 1.998 . . . . 0.0 112.342 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.783 ' CG1' HD23 ' A' ' 39' ' ' LEU . 5.5 m -94.66 -21.95 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.884 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -52.69 164.77 0.33 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.05 178.2 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.27 -63.32 0.38 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -178.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.766 ' HB3' HD23 ' A' ' 37' ' ' LEU . 34.6 m-85 -51.88 -25.98 9.14 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.394 177.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -50.13 -25.96 4.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.186 177.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -61.99 -36.19 80.77 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.702 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.7 mp0 -62.16 -54.89 34.57 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.67 178.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.721 ' N ' HG11 ' A' ' 33' ' ' VAL . 24.2 t80 -54.5 -47.42 73.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.177 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.29 -51.71 64.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.694 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -54.75 -50.02 69.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.959 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HG3' ' CG ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -67.2 -65.0 0.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.722 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.3 t -47.05 -27.64 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 CA-C-O 120.894 0.378 . . . . 0.0 111.072 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.14 -36.61 69.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -84.04 -27.4 28.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.772 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.76 28.54 3.15 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.504 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' CG ' ' HG3' ' A' ' 23' ' ' ARG . 3.6 mt-10 -91.37 160.33 15.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -68.73 111.3 7.83 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.007 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.722 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.6 Cg_exo -54.58 -44.13 52.46 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.94 1.76 . . . . 0.0 111.668 -179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttpt -49.04 -37.03 19.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.246 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -43.97 97.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 176.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.721 HG11 ' N ' ' A' ' 20' ' ' TYR . 21.8 t -58.9 -45.75 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.911 177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.726 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.7 mm? -47.84 -35.57 10.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.977 0.418 . . . . 0.0 110.488 179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.27 -37.01 84.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.942 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -82.62 -38.7 23.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.735 178.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -46.57 -62.21 1.47 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.55 179.214 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 111.8 47.63 0.72 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.751 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -117.06 91.9 3.71 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.924 0.393 . . . . 0.0 110.321 179.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -86.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.818 -178.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt-85 -46.18 133.27 9.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.939 0.4 . . . . 0.0 111.552 -178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.04 -25.71 60.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.625 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.433 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 31.4 p -49.3 -26.21 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.717 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 6' ' ' CYS . 2.2 m -84.68 -56.15 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.458 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.726 ' CG ' HD12 ' A' ' 34' ' ' LEU . 4.3 mtm180 -47.31 -59.71 3.0 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.488 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.677 ' HA ' HD11 ' A' ' 49' ' ' ILE . 18.2 ptp180 -37.78 -43.17 0.64 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.965 0.412 . . . . 0.0 111.944 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.876 ' HE1' ' N ' ' A' ' 6' ' ' CYS . 33.3 mtm -76.03 -39.31 55.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.644 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.899 HD21 HD12 ' A' ' 7' ' ' LEU . 2.6 mt -74.62 -62.38 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.983 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.677 HD11 ' HA ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -41.79 -30.04 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-O 120.902 0.382 . . . . 0.0 111.623 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.9 m -87.64 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.965 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.428 ' O ' ' CG1' ' A' ' 52' ' ' VAL . 8.3 t-160 -87.82 -62.96 1.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.996 -178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 20' ' ' TYR . 4.5 p 45.92 76.55 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.257 0.551 . . . . 0.0 110.967 -177.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.4 94.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.229 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.443 HG23 HG22 ' A' ' 52' ' ' VAL . 5.2 p -97.42 40.06 1.17 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.033 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.994 -179.923 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.43 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 9.3 ptm . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.707 0.289 . . . . 0.0 110.606 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.933 ' HB ' HD23 ' A' ' 7' ' ' LEU . 1.7 mp -64.95 142.42 98.64 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.708 ' HD2' HG23 ' A' ' 2' ' ' ILE . 33.8 Cg_endo -79.69 52.32 4.25 Favored 'Trans proline' 0 CA--C 1.515 -0.471 0 C-N-CA 123.067 2.511 . . . . 0.0 112.001 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 151.46 154.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 124.228 0.955 . . . . 0.0 109.026 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.421 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 78.08 -170.29 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.454 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.694 ' O ' HD22 ' A' ' 7' ' ' LEU . 71.5 m -58.91 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.847 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.052 HD12 HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER 83.83 34.42 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.35 0.595 . . . . 0.0 110.08 -178.235 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 169.75 -72.58 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.911 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m 47.11 27.21 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.438 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.62 -20.58 15.26 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.019 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.08 102.3 21.74 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.615 0.245 . . . . 0.0 110.802 -178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -48.73 134.79 27.96 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.449 2.099 . . . . 0.0 112.332 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.911 HG11 HD23 ' A' ' 39' ' ' LEU . 17.2 m -112.93 -21.25 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.439 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 m -57.27 -37.74 72.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.963 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.25 -38.38 81.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.904 ' HB3' HD23 ' A' ' 37' ' ' LEU . 18.5 m-85 -83.57 -22.07 32.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.602 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -43.18 -29.74 0.41 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.194 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -60.88 -43.28 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.288 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 2.8 tp10 -57.85 -50.27 73.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.287 178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.888 ' HA ' HG11 ' A' ' 33' ' ' VAL . 11.3 t80 -55.11 -47.88 74.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.339 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -53.89 -60.24 3.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.935 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.536 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.3 mmt180 -47.95 -55.71 9.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.012 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -55.36 -66.58 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.289 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.749 HG21 ' CZ ' ' A' ' 20' ' ' TYR . 42.8 t -50.5 -26.34 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.947 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.81 -59.84 3.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.084 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -30.23 71.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.838 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.24 33.17 1.26 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.399 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.43 ' HB2' ' CG ' ' A' ' 23' ' ' ARG . 7.4 mt-10 -93.2 158.29 15.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.866 0.365 . . . . 0.0 111.037 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.24 112.35 9.76 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.445 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.738 ' HG3' HG22 ' A' ' 24' ' ' VAL . 39.3 Cg_exo -57.21 -41.99 67.77 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.209 1.94 . . . . 0.0 111.901 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.89 -38.05 34.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 178.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -41.9 95.82 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.888 HG11 ' HA ' ' A' ' 20' ' ' TYR . 47.6 t -58.82 -44.28 90.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.147 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.79 HD12 ' CG ' ' A' ' 45' ' ' ARG . 3.0 mm? -48.56 -41.82 31.67 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.443 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -62.37 -32.12 72.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.93 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -83.61 -42.34 16.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.887 179.019 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.904 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -47.21 -46.35 24.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.764 179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.27 -43.09 1.57 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.781 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.911 HD23 HG11 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -39.05 113.86 0.35 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.894 0.378 . . . . 0.0 111.451 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -73.2 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.31 -179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -51.93 137.68 26.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.915 0.388 . . . . 0.0 111.001 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.455 ' HB3' ' NH2' ' A' ' 45' ' ' ARG . 12.8 p90 -75.02 -19.75 59.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.119 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 15.8 p -46.9 -29.13 1.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.04 0.448 . . . . 0.0 110.76 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.409 ' HA ' ' CB ' ' A' ' 6' ' ' CYS . 2.8 m -87.26 -56.28 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.371 178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.79 ' CG ' HD12 ' A' ' 34' ' ' LEU . 1.8 mtm105 -48.52 -57.0 6.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.34 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.407 ' HD2' ' HG3' ' A' ' 47' ' ' MET . 0.0 OUTLIER -39.51 -35.28 0.28 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.884 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.475 ' O ' ' CE1' ' A' ' 51' ' ' HIS . 4.1 mtp -87.79 -37.61 16.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.988 0.423 . . . . 0.0 110.77 178.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.052 HD21 HD12 ' A' ' 7' ' ' LEU . 4.7 mt -74.97 -65.66 0.85 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.325 -177.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -38.26 -30.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -177.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -82.0 -79.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.677 0.275 . . . . 0.0 111.31 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.475 ' CE1' ' O ' ' A' ' 47' ' ' MET . 7.7 p80 -89.56 -65.42 1.02 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 52' ' ' VAL . 12.2 p 42.38 29.29 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-O 120.949 0.404 . . . . 0.0 111.542 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 47.75 96.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.108 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.714 HG21 ' HE1' ' A' ' 20' ' ' TYR . 1.3 p -155.49 147.93 23.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.103 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.5 t90 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.947 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 ptm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.955 0.407 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.616 ' HB ' HD23 ' A' ' 7' ' ' LEU . 2.1 mp -64.84 139.89 97.91 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.377 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.841 ' O ' HG23 ' A' ' 4' ' ' VAL . 19.4 Cg_endo -86.49 43.88 1.13 Allowed 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 123.344 2.696 . . . . 0.0 112.934 -178.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.841 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t -170.6 -73.02 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.736 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.66 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -57.21 175.68 0.14 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.774 -177.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.85 101.03 13.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.081 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.095 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.22 41.69 2.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.292 178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 t -164.75 -79.33 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.435 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 75.28 21.84 1.8 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.505 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.47 -22.95 4.33 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.544 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.98 139.48 32.2 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-O 120.566 0.222 . . . . 0.0 111.071 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.18 136.59 56.73 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.493 2.129 . . . . 0.0 112.158 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.718 HG11 HD23 ' A' ' 39' ' ' LEU . 8.6 m -104.81 -21.46 5.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.12 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -59.6 -44.39 93.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.008 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.84 -34.45 75.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.765 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.817 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.27 -24.8 24.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.069 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.2 m-30 -44.51 -33.94 1.92 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.934 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.7 m-20 -57.71 -38.12 74.7 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.329 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 16' ' ' TYR . 5.7 tp10 -62.82 -50.0 72.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.208 178.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.795 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.9 t80 -54.31 -48.78 70.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.114 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 25' ' ' ALA . 2.4 tt0 -54.73 -64.02 0.97 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.725 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mtt85 -48.69 -50.03 35.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.175 0.512 . . . . 0.0 110.754 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.492 ' HD3' ' CB ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -58.39 -64.93 0.75 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.002 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 20' ' ' TYR . 19.7 t -56.0 -25.05 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.972 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -65.49 -60.28 3.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.969 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -69.86 -17.04 63.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.05 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.23 26.05 5.59 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.073 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.492 ' CB ' ' HD3' ' A' ' 23' ' ' ARG . 4.7 mt-10 -87.39 134.6 33.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.969 0.414 . . . . 0.0 110.919 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -48.18 117.14 5.43 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.254 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.653 ' HG3' HG22 ' A' ' 24' ' ' VAL . 19.2 Cg_exo -64.54 -44.78 10.35 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.324 2.016 . . . . 0.0 111.838 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.0 -40.0 13.64 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.019 0.438 . . . . 0.0 110.395 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.54 -42.69 86.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.795 HG11 ' HA ' ' A' ' 20' ' ' TYR . 60.6 t -55.15 -45.65 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.006 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.9 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.64 -44.1 47.26 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.43 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -55.7 -31.84 62.78 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.654 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.3 OUTLIER -86.94 -41.26 14.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.751 178.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.817 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -49.85 -38.41 35.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.099 0.476 . . . . 0.0 110.452 179.302 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 63.0 3.69 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.92 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.771 HD11 ' CB ' ' A' ' 37' ' ' LEU . 1.2 mp -102.59 25.06 9.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.436 . . . . 0.0 111.204 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 tptm 54.15 -90.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.078 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 55.7 mtt180 -82.11 178.96 7.99 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.062 0.458 . . . . 0.0 111.712 -177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.428 ' C ' ' CD1' ' A' ' 42' ' ' TYR . 7.1 p90 -101.68 -20.71 14.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.054 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 46' ' ' ARG . 23.1 p -48.69 -26.59 2.38 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-O 120.94 0.4 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.9 OUTLIER -87.07 -48.69 7.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.102 178.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.9 ' HG2' HD12 ' A' ' 34' ' ' LEU . 85.9 mtt180 -49.41 -60.56 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.672 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -39.49 -39.32 0.68 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -177.915 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.3 mtp -82.71 -29.64 29.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.438 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.095 HD21 HD12 ' A' ' 7' ' ' LEU . 3.6 mt -82.62 -63.37 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.704 -178.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.574 HG23 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -41.27 -28.84 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.673 -178.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.09 -72.47 0.51 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.51 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -88.58 -69.89 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.284 -177.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.6 ' O ' HG13 ' A' ' 52' ' ' VAL . 14.9 p 37.85 71.88 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.743 -177.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -45.74 112.35 0.46 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.322 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.5 p -114.28 37.77 3.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.166 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 50.7 t-105 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.941 -179.972 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.457 ' CE ' ' HB2' ' A' ' 7' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.68 0.276 . . . . 0.0 110.575 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.668 ' HB ' HD23 ' A' ' 7' ' ' LEU . 6.1 mt -84.66 138.61 38.02 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 111.313 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.64 ' HD2' HG23 ' A' ' 2' ' ' ILE . 91.1 Cg_endo -72.29 178.89 5.54 Favored 'Trans proline' 0 CA--C 1.514 -0.505 0 C-N-CA 122.744 2.296 . . . . 0.0 111.444 178.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.587 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.38 -73.43 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 120.981 0.42 . . . . 0.0 110.99 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.587 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -67.73 -173.36 0.33 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.442 0.639 . . . . 0.0 112.171 -178.511 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.79 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.9 m -57.17 -162.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.632 176.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.79 HD22 ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 92.19 32.83 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.633 0.773 . . . . 0.0 110.474 -179.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.87 -67.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.514 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 6.2 m 48.54 25.83 1.04 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.279 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.95 -21.33 12.37 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.502 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.35 161.1 25.92 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 120.836 0.351 . . . . 0.0 111.282 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -92.52 123.55 0.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.173 2.582 . . . . 0.0 112.731 -179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 1.025 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -122.92 12.99 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.345 179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -80.5 -66.5 0.87 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.834 0.35 . . . . 0.0 111.112 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.32 -21.1 8.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.413 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.962 ' HB3' HD23 ' A' ' 37' ' ' LEU . 14.2 m-85 -86.15 -27.13 24.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.445 -178.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.534 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.8 m-30 -49.04 -31.33 7.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -59.04 -35.65 73.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.006 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -63.84 -55.67 21.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.147 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.926 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.9 t80 -51.16 -48.52 61.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.42 178.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.97 -53.69 55.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.859 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -51.12 -52.59 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.987 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' CB ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -61.58 -64.34 0.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.016 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.725 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.9 t -48.96 -29.6 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.24 -179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.93 75.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.928 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -74.96 -30.53 61.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.01 27.02 2.59 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.538 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.2 mt-10 -84.42 163.79 19.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.969 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.62 111.28 9.78 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.287 179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.725 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.7 Cg_exo -56.3 -42.1 69.5 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.043 1.829 . . . . 0.0 111.913 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -49.17 -37.92 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.528 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.99 -40.72 95.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.926 HG11 ' HA ' ' A' ' 20' ' ' TYR . 56.8 t -59.09 -42.6 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.961 177.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.713 ' HA ' HD12 ' A' ' 37' ' ' LEU . 2.7 mm? -51.37 -37.36 47.73 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.065 0.459 . . . . 0.0 110.052 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -60.22 -35.69 76.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.448 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -82.81 -44.08 15.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.842 178.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.962 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.8 mt -43.76 -36.14 2.15 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.243 0.544 . . . . 0.0 110.674 179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.55 67.39 2.13 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.938 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.025 HD23 HG11 ' A' ' 13' ' ' VAL . 2.7 mp -101.24 -160.94 0.82 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.56 0.219 . . . . 0.0 111.193 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -108.26 -88.08 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.441 ' O ' ' CZ ' ' A' ' 45' ' ' ARG . 3.7 mmm180 -104.08 150.04 24.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.906 0.384 . . . . 0.0 111.983 -177.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 2.2 p90 -56.02 -32.14 63.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.281 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 12.5 p -40.85 -30.71 0.13 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.101 0.477 . . . . 0.0 111.174 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.448 ' HB2' ' NE ' ' A' ' 45' ' ' ARG . 5.1 m -84.6 -56.4 3.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.771 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.923 ' HD2' HD13 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -46.35 -50.56 16.24 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.576 -179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HD3' ' HG3' ' A' ' 47' ' ' MET . 0.4 OUTLIER -42.74 -35.17 1.06 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.886 0.374 . . . . 0.0 111.161 -179.627 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.45 ' CE ' ' HB2' ' A' ' 6' ' ' CYS . 4.6 mtp -88.11 -32.57 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.673 177.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.767 HD21 HD12 ' A' ' 7' ' ' LEU . 8.3 mt -75.65 -70.8 0.41 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.019 -177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.657 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -39.81 -31.15 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.933 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -77.76 -77.38 0.16 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.029 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' VAL . 2.6 t60 -88.02 -72.82 0.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.688 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 52' ' ' VAL . 14.7 p 42.49 34.8 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.492 -178.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.459 ' O ' HG23 ' A' ' 54' ' ' THR . 1.5 tt0 61.05 96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.82 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 53' ' ' GLU . 2.0 p -157.02 111.63 2.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.125 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.878 179.986 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.417 ' HE3' ' HB2' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.16 0 CA-C-O 121.294 0.568 . . . . 0.0 111.42 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.61 HG23 ' HD2' ' A' ' 3' ' ' PRO . 74.5 mt -54.08 140.55 52.17 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.686 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.701 ' O ' HG23 ' A' ' 4' ' ' VAL . 27.6 Cg_endo -81.22 52.22 4.23 Favored 'Trans proline' 0 CA--C 1.514 -0.518 0 C-N-CA 122.962 2.442 . . . . 0.0 111.6 178.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.701 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.91 167.55 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 124.254 0.971 . . . . 0.0 108.504 -174.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 81.3 -166.62 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.015 0.436 . . . . 0.0 111.175 -179.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.962 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -109.34 101.48 10.46 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.018 179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.979 HD12 HD21 ' A' ' 48' ' ' LEU . 1.7 mm? -139.46 38.58 2.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.012 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.428 ' HA ' ' CG1' ' A' ' 13' ' ' VAL . 3.4 m -170.56 -67.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.755 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 71.43 25.94 3.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.246 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.48 -21.11 8.71 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.634 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.0 OUTLIER -115.98 158.28 42.82 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.845 0.355 . . . . 0.0 110.948 -179.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -84.52 126.52 3.58 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.695 2.263 . . . . 0.0 112.045 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.891 HG12 HD23 ' A' ' 39' ' ' LEU . 1.9 m -109.99 -6.04 11.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.84 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.4 m -64.14 -69.68 0.27 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.808 0.337 . . . . 0.0 111.599 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.78 -24.88 6.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.555 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.954 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.7 m-85 -87.0 -28.03 22.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.602 -178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 2.9 m-30 -48.69 -31.27 6.55 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.859 0.362 . . . . 0.0 110.827 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -61.21 -33.39 73.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.235 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -65.98 -45.17 82.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.187 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.907 ' HA ' HG11 ' A' ' 33' ' ' VAL . 10.6 t80 -59.36 -47.52 85.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.987 177.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -61.12 -50.0 75.0 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.851 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -53.64 -51.39 63.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.761 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -63.56 -62.35 1.72 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.809 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.741 HG22 ' HG3' ' A' ' 30' ' ' PRO . 57.8 t -50.21 -33.56 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.954 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.91 -56.38 22.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.881 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -68.62 -33.66 74.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.723 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 121.46 31.73 1.12 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.6 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -89.66 160.86 16.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.52 113.34 18.88 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.569 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.741 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -57.82 -39.02 90.48 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.279 1.986 . . . . 0.0 111.921 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -48.68 -39.93 26.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.036 0.446 . . . . 0.0 110.172 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.51 -40.21 89.09 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.332 176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.907 HG11 ' HA ' ' A' ' 20' ' ' TYR . 58.3 t -58.22 -44.23 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.967 177.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.892 HD12 ' HG3' ' A' ' 45' ' ' ARG . 2.2 mm? -48.88 -43.55 39.09 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 120.923 0.392 . . . . 0.0 110.368 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.56 -33.2 69.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.889 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.1 OUTLIER -83.82 -43.31 15.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.66 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -45.12 -41.22 7.69 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.526 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.28 48.23 4.38 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.933 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.891 HD23 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -127.26 115.02 18.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.805 0.336 . . . . 0.0 110.707 179.446 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.435 ' O ' ' NH2' ' A' ' 45' ' ' ARG . 9.3 mptt -67.62 -171.37 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.743 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 47.48 -174.46 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.021 0.439 . . . . 0.0 111.217 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.456 ' CD1' ' HB2' ' A' ' 45' ' ' ARG . 1.6 t80 -141.95 14.67 2.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.143 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 p -72.13 -31.0 65.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.48 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 2.5 m -87.81 -50.17 6.63 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.195 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.892 ' HG3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -45.67 -57.43 4.23 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.278 -177.152 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.443 ' NE ' ' HG3' ' A' ' 47' ' ' MET . 0.6 OUTLIER -44.28 -33.23 1.52 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.964 0.411 . . . . 0.0 110.997 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.443 ' HG3' ' NE ' ' A' ' 46' ' ' ARG . 16.9 mtm -87.39 -31.77 19.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.979 HD21 HD12 ' A' ' 7' ' ' LEU . 10.5 mt -79.7 -65.52 0.99 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.514 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.56 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.55 -32.27 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.932 -178.007 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -80.89 -77.84 0.19 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.713 -178.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.518 ' O ' HG12 ' A' ' 52' ' ' VAL . 21.4 t60 -87.65 -74.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 112.019 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 52' ' ' VAL . 9.6 p 44.98 28.98 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -178.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 108.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.3 p -153.19 129.25 10.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 m0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.858 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.62 ' C ' HD12 ' A' ' 2' ' ' ILE . 1.4 ppp? . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.991 0.424 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.683 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.8 mp -112.92 139.3 22.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.387 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.625 ' HD2' HG23 ' A' ' 2' ' ' ILE . 80.0 Cg_endo -73.3 178.97 5.94 Favored 'Trans proline' 0 CA--C 1.515 -0.472 0 C-N-CA 122.495 2.13 . . . . 0.0 110.715 177.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.5 -77.11 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.978 177.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.703 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.3 OUTLIER -52.25 -172.06 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.763 -178.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -108.9 99.42 8.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.444 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -137.23 38.57 2.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.364 177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.455 ' HA ' HG13 ' A' ' 13' ' ' VAL . 5.6 m -174.56 -55.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.786 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.59 23.46 13.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.161 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 122.0 -21.98 7.72 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.336 -179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.15 136.87 24.65 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.588 0.232 . . . . 0.0 110.87 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.03 130.93 27.12 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.435 2.09 . . . . 0.0 112.247 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.744 ' CG1' HD23 ' A' ' 39' ' ' LEU . 4.0 m -107.76 -18.25 7.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.321 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -59.6 -52.56 65.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.84 0.352 . . . . 0.0 111.133 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.02 70.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.022 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.852 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.0 m-85 -87.26 -25.92 23.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.208 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.0 m-30 -47.07 -28.23 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.799 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -61.74 -37.52 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.124 178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' CD ' HG13 ' A' ' 33' ' ' VAL . 1.1 tt0 -61.49 -51.36 68.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.17 178.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 25.8 t80 -58.35 -46.26 86.59 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.408 178.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.1 tt0 -59.13 -56.2 25.24 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.3 ttt85 -55.36 -51.55 66.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.843 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.4 OUTLIER -61.37 -66.72 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.865 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.787 HG22 ' HG3' ' A' ' 30' ' ' PRO . 58.2 t -49.59 -29.41 4.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -62.79 -49.7 73.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.95 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.21 -29.08 60.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.06 25.7 2.68 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.659 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -84.08 150.88 25.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.815 0.341 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.92 108.0 1.18 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.691 179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.787 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.6 Cg_exo -58.88 -43.25 45.07 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.253 1.969 . . . . 0.0 111.998 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.11 -40.7 24.3 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.333 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.47 -43.55 93.84 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.2 t -56.11 -43.88 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.148 178.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.739 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.6 mm? -49.94 -42.64 48.91 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.335 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.9 -30.58 69.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.774 178.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' VAL . 41.3 m-20 -86.28 -40.92 15.02 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.712 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.852 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -49.67 -40.7 40.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.689 179.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.21 58.71 5.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.359 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.8 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.4 OUTLIER -102.04 -23.81 14.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.832 0.348 . . . . 0.0 111.117 -179.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt 66.39 144.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? 61.04 139.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.937 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -80.23 -19.06 47.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 21.0 p -46.88 -32.16 3.59 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.988 0.423 . . . . 0.0 110.645 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.7 m -87.77 -57.25 3.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.441 177.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HG2' HD12 ' A' ' 34' ' ' LEU . 5.4 mtm180 -44.02 -55.28 4.78 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.656 -179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -39.82 -44.01 1.54 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.683 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.403 ' HE2' ' HB2' ' A' ' 47' ' ' MET . 14.0 mtm -80.37 -31.08 37.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.856 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 7' ' ' LEU . 8.5 mt -79.71 -66.52 0.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.165 -178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.516 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -40.68 -28.97 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -177.165 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.6 -78.6 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.96 0.41 . . . . 0.0 111.645 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 52' ' ' VAL . 93.9 m-70 -88.87 -69.72 0.69 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.219 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.5 p 46.08 29.42 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.015 -177.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.2 -88.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.025 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 p 43.7 46.78 6.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.82 0.343 . . . . 0.0 111.585 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.058 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.845 0.355 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.573 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.4 mp -65.85 136.15 95.64 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.149 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' A' ' 2' ' ' ILE . 52.9 Cg_endo -78.03 177.83 8.31 Favored 'Trans proline' 0 CA--C 1.515 -0.434 0 C-N-CA 122.731 2.287 . . . . 0.0 111.015 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.68 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 65.0 -76.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.637 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.68 ' N ' HG12 ' A' ' 4' ' ' VAL . 2.0 tpp180 -54.67 176.69 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.641 -179.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.908 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -103.85 103.25 13.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.994 179.848 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.048 HD12 HD21 ' A' ' 48' ' ' LEU . 1.4 mm? -133.49 42.58 2.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.542 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -177.55 -69.19 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.699 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.2 23.1 4.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.272 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 129.85 -22.8 4.81 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.555 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -126.03 141.44 39.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.826 0.346 . . . . 0.0 111.175 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.75 133.36 33.7 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.531 2.154 . . . . 0.0 112.164 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.681 HG11 HD23 ' A' ' 39' ' ' LEU . 4.8 m -108.76 -28.24 2.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.064 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -56.52 -43.04 79.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.88 -34.17 77.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.096 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.801 ' HB3' HD23 ' A' ' 37' ' ' LEU . 12.3 m-85 -86.59 -23.56 25.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.544 ' CE1' HG23 ' A' ' 13' ' ' VAL . 3.1 m-30 -44.49 -29.76 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.032 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -40.78 94.37 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' N ' ' O ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -59.35 -51.76 68.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.226 178.655 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.701 ' HA ' HG11 ' A' ' 33' ' ' VAL . 18.5 t80 -54.49 -48.49 71.78 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.302 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.0 tt0 -60.14 -53.15 61.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.484 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -56.08 -49.74 72.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.632 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -65.06 -66.35 0.56 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.963 179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 30' ' ' PRO . 61.1 t -47.93 -31.33 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -61.73 -46.37 89.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.416 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 16.5 t0 -74.33 -39.42 62.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.71 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 127.13 29.04 0.88 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.196 179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 26' ' ' ASP . 1.8 mt-10 -90.71 154.72 19.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.923 0.361 . . . . 0.0 110.774 179.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.28 109.12 1.86 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.49 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.794 ' HG3' HG22 ' A' ' 24' ' ' VAL . 32.5 Cg_exo -55.42 -39.72 89.46 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.158 1.905 . . . . 0.0 111.586 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.19 -40.19 46.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.215 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -44.74 89.25 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 176.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.2 t -55.27 -45.11 77.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.969 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.774 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.9 mm? -50.54 -41.06 53.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -59.69 -30.49 68.82 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.625 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -87.16 -40.95 14.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.677 178.867 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.915 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -48.78 -54.62 14.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.534 179.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.86 52.87 0.88 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.044 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.915 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -126.7 77.2 1.7 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.923 0.392 . . . . 0.0 110.919 -179.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 41' ' ' ARG . 12.9 mmmt -54.04 -172.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.473 ' O ' ' CB ' ' A' ' 42' ' ' TYR . 0.1 OUTLIER 71.65 -54.34 0.68 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 41' ' ' ARG . 3.6 t80 93.03 -23.42 0.06 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.274 0.63 . . . . 0.0 110.654 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 19.3 p -51.39 -28.27 12.26 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.106 0.479 . . . . 0.0 110.075 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.411 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 3.2 m -86.93 -55.92 3.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.184 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.774 ' CG ' HD12 ' A' ' 34' ' ' LEU . 3.3 mtm180 -46.0 -55.76 6.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.269 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.62 -36.57 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.776 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.455 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 44.6 mtm -87.88 -31.44 19.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.777 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.048 HD21 HD12 ' A' ' 7' ' ' LEU . 6.1 mt -77.3 -65.3 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.636 -178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.492 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -41.87 -29.39 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.667 -178.334 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.1 m -84.74 -76.7 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.305 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -87.86 -63.99 1.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.662 ' O ' HG13 ' A' ' 52' ' ' VAL . 12.6 p 37.37 94.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 121.078 0.466 . . . . 0.0 111.745 -176.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -66.37 103.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.023 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.4 p -100.42 -39.25 8.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.02 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 64.5 p-90 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.864 179.883 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.864 ' C ' HD12 ' A' ' 2' ' ' ILE . 13.1 ptm . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.993 0.425 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.864 HD12 ' C ' ' A' ' 1' ' ' MET . 2.0 mp -127.15 132.4 24.3 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.37 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' O ' ' N ' ' A' ' 5' ' ' ARG . 95.2 Cg_endo -71.01 179.36 4.44 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 C-N-CA 122.435 2.09 . . . . 0.0 110.458 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.68 -77.13 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.604 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.689 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -56.5 175.92 0.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.481 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.886 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -103.32 102.51 12.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.314 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.019 HD12 HD21 ' A' ' 48' ' ' LEU . 1.6 mm? -134.32 42.22 2.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.713 178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.444 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.3 m -175.15 -62.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.775 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 66.15 15.16 9.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.774 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.61 -33.94 1.74 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.408 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.36 142.16 36.4 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 120.712 0.291 . . . . 0.0 110.843 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -63.2 135.14 49.02 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.451 2.1 . . . . 0.0 112.119 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.808 HG11 HD23 ' A' ' 39' ' ' LEU . 4.9 m -106.63 -17.32 7.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.383 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 m -59.16 -56.77 17.87 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.844 0.355 . . . . 0.0 111.241 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.7 -29.15 64.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.841 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.19 -26.73 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.281 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 3.1 m-30 -47.63 -27.33 1.84 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.378 . . . . 0.0 110.779 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.84 -36.69 84.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.15 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 16' ' ' TYR . 1.8 tp10 -63.69 -48.92 75.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.23 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.846 ' HA ' HG11 ' A' ' 33' ' ' VAL . 17.8 t80 -56.16 -48.23 76.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.24 178.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.5 tt0 -55.66 -58.96 5.65 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.905 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -50.79 -50.35 56.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.87 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.77 HG22 ' HG3' ' A' ' 30' ' ' PRO . 41.8 t -54.76 -24.8 14.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.139 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -63.66 -52.99 58.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.097 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.03 -24.87 58.38 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.899 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.64 22.99 3.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.587 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -79.94 146.91 31.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.773 0.321 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.61 109.59 1.88 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.621 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.77 ' HG3' HG22 ' A' ' 24' ' ' VAL . 37.4 Cg_exo -58.3 -41.9 61.59 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.198 1.932 . . . . 0.0 111.75 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -47.94 -42.2 26.76 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.965 0.412 . . . . 0.0 110.4 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.94 -38.85 92.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.513 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 20' ' ' TYR . 53.5 t -60.28 -43.06 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.09 177.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.75 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -50.05 -41.32 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.177 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.57 -34.28 72.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.633 177.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.33 -44.29 16.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.909 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.841 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -46.9 -52.31 14.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.773 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.4 56.45 1.27 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.792 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.839 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -119.45 100.05 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.4 150.87 14.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.991 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 60.57 148.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.978 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -84.83 -16.41 41.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.259 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 11.0 p -45.85 -31.61 2.2 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.959 0.409 . . . . 0.0 110.684 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 2.6 m -87.27 -60.85 1.86 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.368 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.75 ' CG ' HD12 ' A' ' 34' ' ' LEU . 6.6 mtm180 -44.31 -50.9 8.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.648 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.9 ptt180 -42.29 -44.3 3.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.926 0.394 . . . . 0.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.7 mtp -80.53 -27.1 37.7 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.019 HD21 HD12 ' A' ' 7' ' ' LEU . 9.9 mt -80.98 -69.88 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.618 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.513 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.21 -29.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 120.911 0.386 . . . . 0.0 111.61 -178.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 51.6 m -83.57 -77.1 0.26 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.208 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.69 ' O ' HG12 ' A' ' 52' ' ' VAL . 83.6 t60 -87.95 -77.07 0.36 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 112.067 -178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 51' ' ' HIS . 9.9 p 54.36 135.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 123.666 0.787 . . . . 0.0 112.31 -178.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -82.13 119.42 24.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.889 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.6 p -128.0 25.33 5.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.001 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 43.6 t-105 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 0.0 110.938 -179.922 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 CA--C 1.523 -0.08 0 CA-C-O 120.72 0.295 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 2' ' ' ILE . 2.0 mp -71.39 136.92 83.78 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.089 179.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.558 ' HD2' HG23 ' A' ' 2' ' ' ILE . 64.2 Cg_endo -74.74 178.75 6.75 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.571 2.181 . . . . 0.0 111.01 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.65 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.89 -76.18 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.571 177.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.65 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -63.11 161.79 12.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.408 -179.643 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.896 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -90.85 105.15 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.835 178.718 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.127 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.28 38.57 3.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.854 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.7 m -171.81 -72.1 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 71.35 14.15 6.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.703 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 141.41 -29.52 2.27 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.446 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -126.4 142.12 41.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 120.826 0.346 . . . . 0.0 110.991 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.11 138.35 66.77 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.441 2.094 . . . . 0.0 112.291 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.58 HG11 HD23 ' A' ' 39' ' ' LEU . 6.2 m -110.72 -33.31 2.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.74 -49.21 63.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.306 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.57 -33.7 68.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.028 0.442 . . . . 0.0 110.791 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.804 ' HB3' HD23 ' A' ' 37' ' ' LEU . 13.3 m-85 -87.63 -23.77 24.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.594 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.567 ' CZ ' HD22 ' A' ' 48' ' ' LEU . 4.5 m-30 -44.43 -33.95 1.87 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.829 0.347 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -56.28 -40.11 73.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.184 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 16' ' ' TYR . 4.9 tp10 -60.69 -52.0 66.99 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.172 178.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.736 ' HA ' HG11 ' A' ' 33' ' ' VAL . 21.2 t80 -53.22 -48.9 67.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.8 177.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -52.91 -69.91 0.1 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.664 178.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -44.88 -51.64 9.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.399 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.542 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.76 -65.12 0.74 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.875 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 20' ' ' TYR . 60.7 t -48.6 -32.22 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.202 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -60.99 2.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -61.17 -30.99 70.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.931 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 118.69 27.31 2.36 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.629 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -84.45 146.61 27.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.803 0.335 . . . . 0.0 110.847 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.22 107.82 1.04 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.639 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.727 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.6 Cg_exo -56.51 -40.38 84.88 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.192 1.928 . . . . 0.0 111.824 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -49.88 -40.16 41.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.24 178.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -45.56 86.37 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 176.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.736 HG11 ' HA ' ' A' ' 20' ' ' TYR . 57.6 t -54.75 -44.53 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.092 178.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.715 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.9 mm? -49.32 -44.46 44.39 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.583 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.79 -30.79 65.96 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.695 178.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 1.2 m-20 -86.94 -41.1 14.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.868 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.855 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -47.08 -51.22 18.27 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.64 179.337 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.5 51.71 1.19 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.929 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.855 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -116.38 95.19 4.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.079 0.466 . . . . 0.0 110.236 179.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -40.33 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.385 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -56.47 149.34 17.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.901 0.381 . . . . 0.0 111.425 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -82.03 -22.78 36.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.936 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 30.0 p -47.42 -27.93 1.9 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.991 0.424 . . . . 0.0 110.569 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.2 m -82.62 -55.96 4.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.715 ' HG2' HD12 ' A' ' 34' ' ' LEU . 46.2 mtt180 -48.67 -59.73 3.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HA ' HD11 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -36.78 -33.22 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.877 -179.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.47 ' CE ' ' CG ' ' A' ' 5' ' ' ARG . 3.2 mtp -87.24 -47.05 9.16 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.575 0.702 . . . . 0.0 110.504 178.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.127 HD21 HD12 ' A' ' 7' ' ' LEU . 5.9 mt -65.38 -63.7 1.04 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.173 -176.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.57 HG23 HD21 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -42.35 -29.34 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.633 -178.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.7 m -87.45 -77.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -88.38 -58.75 2.44 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.5 p 43.58 95.65 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 0.0 111.132 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -58.11 117.34 4.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.935 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -112.12 -26.9 8.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.968 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.4 m0 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.138 -0.935 . . . . 0.0 110.979 -179.648 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ppp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.761 0.315 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.552 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.4 mp -69.96 133.21 88.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.068 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.433 ' O ' ' N ' ' A' ' 5' ' ' ARG . 68.6 Cg_endo -74.11 179.35 5.85 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 122.545 2.164 . . . . 0.0 110.918 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.689 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.81 -76.96 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.136 0.493 . . . . 0.0 110.753 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.689 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -54.74 -174.09 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.681 -178.84 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.946 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -113.23 98.42 7.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.098 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.05 HD12 HD21 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -132.98 38.32 3.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.766 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 11' ' ' LYS . 3.1 m -173.79 -66.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.003 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.92 22.46 8.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.005 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 128.97 -19.6 5.47 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.502 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' SER . 0.2 OUTLIER -130.41 146.68 62.74 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.89 0.376 . . . . 0.0 111.301 -179.334 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.0 Cg_endo -69.75 135.13 29.7 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.65 2.233 . . . . 0.0 112.396 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.616 HG11 HD23 ' A' ' 39' ' ' LEU . 4.4 m -112.82 -35.25 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 m -47.01 -51.35 17.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.541 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.94 -27.14 69.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.014 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.838 ' HB3' HD23 ' A' ' 37' ' ' LEU . 31.0 m-85 -87.49 -20.66 26.24 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.654 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.568 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 4.0 m-30 -46.52 -28.17 1.33 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.006 0.431 . . . . 0.0 110.193 178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.28 -39.9 73.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.189 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.704 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -61.37 -54.93 37.32 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.199 0.523 . . . . 0.0 109.794 177.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.681 ' N ' HG11 ' A' ' 33' ' ' VAL . 42.3 t80 -54.92 -47.49 74.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.163 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 6.3 tt0 -63.35 -53.43 52.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.807 179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -55.46 -50.6 69.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.824 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -67.97 -64.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.975 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' HG3' ' A' ' 30' ' ' PRO . 95.1 t -47.57 -32.87 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.11 0 CA-C-O 120.851 0.358 . . . . 0.0 110.828 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -54.97 -60.15 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.845 179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 26.7 t0 -66.95 -35.15 79.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.658 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.8 27.27 1.29 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.128 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 23' ' ' ARG . 2.2 mt-10 -83.22 149.25 26.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.845 0.355 . . . . 0.0 110.861 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -56.16 109.94 2.0 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.472 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.804 ' HG3' HG22 ' A' ' 24' ' ' VAL . 31.2 Cg_exo -57.62 -41.94 65.63 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.215 1.943 . . . . 0.0 111.71 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -49.65 -36.54 25.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -43.31 79.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.704 HG13 ' HB3' ' A' ' 19' ' ' GLU . 38.6 t -56.71 -44.03 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.613 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.781 HD12 ' HG2' ' A' ' 45' ' ' ARG . 2.8 mm? -48.87 -42.44 36.6 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.026 0.441 . . . . 0.0 110.431 178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.47 -32.57 70.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.06 178.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.4 OUTLIER -86.89 -40.33 14.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.929 179.291 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.838 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.27 -58.13 4.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.146 0.498 . . . . 0.0 110.467 179.312 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 114.47 44.95 0.69 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.062 178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -121.78 100.08 6.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.837 0.351 . . . . 0.0 110.369 179.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.12 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.781 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 64.5 mmt-85 -46.82 140.63 4.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 111.472 -178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -77.9 -21.16 51.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.131 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 25.4 p -48.38 -27.31 2.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.901 0.381 . . . . 0.0 110.776 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -86.49 -55.3 3.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.486 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.781 ' HG2' HD12 ' A' ' 34' ' ' LEU . 66.3 mtt180 -48.94 -57.87 5.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.266 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 ppt_? -42.69 -32.81 0.63 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.893 0.378 . . . . 0.0 111.337 -179.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.479 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -87.25 -29.89 21.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.987 179.789 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.05 HD21 HD12 ' A' ' 7' ' ' LEU . 2.5 mt -87.15 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.892 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.612 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -38.95 -30.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -177.397 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -77.31 0.3 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.332 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.516 ' O ' HG12 ' A' ' 52' ' ' VAL . 1.5 t-160 -87.93 -67.81 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -178.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 52' ' ' VAL . 11.7 p 45.42 33.7 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.277 -177.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 70.63 -68.51 0.21 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.076 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.461 HG23 HG13 ' A' ' 52' ' ' VAL . 0.8 OUTLIER 52.29 96.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.082 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.961 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.417 ' CE ' ' O ' ' A' ' 2' ' ' ILE . 4.6 ptm . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.979 0.418 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.676 HG23 ' HD2' ' A' ' 3' ' ' PRO . 1.9 mp -77.59 141.06 64.54 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.309 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.676 ' HD2' HG23 ' A' ' 2' ' ' ILE . 42.3 Cg_endo -74.84 157.55 43.38 Favored 'Trans proline' 0 CA--C 1.513 -0.564 0 C-N-CA 122.265 1.977 . . . . 0.0 109.979 177.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.423 ' HB ' ' O ' ' A' ' 3' ' ' PRO . 2.9 t 60.75 160.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.767 0 C-N-CA 119.506 -0.878 . . . . 0.0 109.279 179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.4 OUTLIER 80.0 -161.86 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.827 0.346 . . . . 0.0 111.034 -179.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.792 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -117.94 94.31 4.47 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.612 -179.289 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.981 HD12 HD21 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -130.22 39.83 3.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.469 177.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.44 ' HA ' HG13 ' A' ' 13' ' ' VAL . 3.5 m -170.38 -64.19 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.694 -179.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 64.37 22.12 12.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.282 179.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 133.39 -25.82 3.58 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.169 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.5 139.97 37.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.726 0.298 . . . . 0.0 111.151 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -66.55 128.74 19.72 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.514 2.142 . . . . 0.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.852 HG11 HD23 ' A' ' 39' ' ' LEU . 3.5 m -102.49 12.05 7.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.43 -67.68 0.67 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.796 0.332 . . . . 0.0 111.228 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.26 -24.47 7.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.504 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.937 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.4 m-85 -87.27 -28.28 22.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.775 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' CZ ' HG23 ' A' ' 52' ' ' VAL . 2.5 m-30 -48.95 -28.17 3.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.796 0.331 . . . . 0.0 110.634 178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -61.92 -32.08 72.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.982 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.3 -49.86 57.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.216 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.828 ' HA ' HG11 ' A' ' 33' ' ' VAL . 14.3 t80 -54.01 -49.46 68.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.088 177.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -54.56 -56.54 17.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.826 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 4.4 mtt180 -53.62 -53.89 45.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -60.22 4.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.994 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.786 HG22 ' HG3' ' A' ' 30' ' ' PRO . 87.2 t -50.24 -29.54 6.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.768 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 22' ' ' ARG . . . -66.44 -63.37 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.959 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -56.33 -24.83 46.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.924 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.04 30.37 3.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.519 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -92.73 146.2 23.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.77 0.319 . . . . 0.0 110.998 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.96 115.53 21.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.416 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.786 ' HG3' HG22 ' A' ' 24' ' ' VAL . 52.4 Cg_exo -53.94 -36.52 83.94 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.176 1.917 . . . . 0.0 112.252 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -46.32 -45.06 17.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.965 0.412 . . . . 0.0 110.665 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -39.71 92.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.619 176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -58.75 -45.04 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.164 178.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.68 -42.35 45.39 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.946 0.403 . . . . 0.0 110.142 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -57.23 -34.37 68.51 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.644 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.2 OUTLIER -82.69 -43.49 16.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.585 178.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.937 HD23 ' HB3' ' A' ' 16' ' ' TYR . 0.8 OUTLIER -47.46 -49.93 24.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.699 179.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.8 58.34 1.43 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.879 178.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.868 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -118.01 122.27 42.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.778 0.323 . . . . 0.0 110.839 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.73 153.9 32.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.3 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? 60.94 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.067 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.449 ' HA ' ' CD ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -74.52 -20.71 59.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.068 179.7 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 22.7 p -48.08 -26.97 2.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.958 0.409 . . . . 0.0 110.955 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.7 m -87.24 -62.18 1.56 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.796 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.819 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -44.8 -53.22 7.68 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.624 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -38.71 -44.83 1.04 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.937 0.399 . . . . 0.0 111.732 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.464 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 8.1 mtm -79.34 -36.96 38.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.442 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.981 HD21 HD12 ' A' ' 7' ' ' LEU . 7.5 mt -72.38 -68.39 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.776 -178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.457 ' CG2' ' CD2' ' A' ' 34' ' ' LEU . 0.9 OUTLIER -41.76 -30.58 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 111.781 -178.27 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -71.53 0.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.21 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -87.66 -77.04 0.36 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.855 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.561 HG23 ' CZ ' ' A' ' 17' ' ' PHE . 8.0 p 40.47 33.04 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.638 -178.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' C ' HG23 ' A' ' 54' ' ' THR . 0.7 OUTLIER 66.52 -160.05 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.681 -179.39 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.672 HG21 ' HE1' ' A' ' 20' ' ' TYR . 1.2 p 74.3 23.58 2.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.069 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 45.0 t-105 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.886 -179.974 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HE2' ' HB2' ' A' ' 7' ' ' LEU . 3.4 ppp? . . . . . 0 CA--C 1.522 -0.101 0 CA-C-O 120.925 0.393 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.657 HD12 ' N ' ' A' ' 2' ' ' ILE . 1.7 mp -85.98 135.62 37.24 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.548 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.497 ' HD2' HG23 ' A' ' 2' ' ' ILE . 57.2 Cg_endo -78.13 179.33 6.6 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 122.572 2.181 . . . . 0.0 110.974 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.688 HG12 ' N ' ' A' ' 5' ' ' ARG . 2.1 t 64.84 -76.77 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.208 0.528 . . . . 0.0 110.892 177.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.688 ' N ' HG12 ' A' ' 4' ' ' VAL . 0.0 OUTLIER -51.95 -175.64 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.918 -178.397 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.912 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -107.17 96.96 6.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.495 -178.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.004 HD12 HD21 ' A' ' 48' ' ' LEU . 1.2 mm? -132.36 40.44 3.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.241 177.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.451 ' HA ' HG13 ' A' ' 13' ' ' VAL . 2.3 m -167.41 -67.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.582 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 67.79 20.16 9.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.62 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.55 -22.72 3.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.584 179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.5 mptt -134.44 155.54 79.64 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.743 0.306 . . . . 0.0 111.205 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.69 132.17 16.93 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.676 2.251 . . . . 0.0 112.063 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.817 ' CG1' HD23 ' A' ' 39' ' ' LEU . 8.8 m -103.13 -16.54 7.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.222 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.75 -54.98 38.62 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.891 0.377 . . . . 0.0 111.078 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.33 -31.7 61.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.907 ' HB3' HD23 ' A' ' 37' ' ' LEU . 10.6 m-85 -87.47 -25.91 23.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.512 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.467 ' CD1' ' O ' ' A' ' 13' ' ' VAL . 3.4 m-30 -47.61 -31.6 4.67 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.869 0.366 . . . . 0.0 110.664 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -58.47 -32.04 68.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.213 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -70.6 -51.5 27.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.403 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.783 ' HA ' HG11 ' A' ' 33' ' ' VAL . 27.5 t80 -54.81 -49.05 71.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.245 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -59.13 -55.37 35.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.512 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -51.8 -53.61 38.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.481 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' HG2' HG22 ' A' ' 33' ' ' VAL . 2.6 mpt_? -60.79 -67.88 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.431 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.824 HG22 ' HG3' ' A' ' 30' ' ' PRO . 60.0 t -49.25 -31.8 5.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -57.71 -58.52 7.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.1 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -65.78 -54.95 20.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.97 42.03 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.569 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.437 ' CB ' ' HG3' ' A' ' 23' ' ' ARG . 3.1 mt-10 -102.93 148.29 25.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.901 0.382 . . . . 0.0 111.229 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -58.19 110.03 2.26 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.498 179.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.824 ' HG3' HG22 ' A' ' 24' ' ' VAL . 38.3 Cg_exo -58.14 -41.79 63.88 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.147 1.898 . . . . 0.0 111.703 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.36 -41.52 28.88 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.373 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.53 -42.28 95.83 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 176.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.783 HG11 ' HA ' ' A' ' 20' ' ' TYR . 61.9 t -57.13 -43.01 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.179 177.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.71 HD12 ' CG ' ' A' ' 45' ' ' ARG . 2.8 mm? -51.08 -42.17 60.41 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.317 178.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -57.87 -32.91 68.14 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.783 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.33 -42.76 14.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.756 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.907 HD23 ' HB3' ' A' ' 16' ' ' TYR . 1.1 mt -47.54 -37.46 12.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.619 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.7 64.16 3.61 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.422 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.857 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.3 OUTLIER -107.86 -22.96 12.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.709 0.29 . . . . 0.0 111.176 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.73 155.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.964 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 56.95 110.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.872 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.2 p90 -58.92 -20.23 49.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.338 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 28.1 p -48.51 -28.99 3.7 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.996 0.427 . . . . 0.0 110.508 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.8 m -87.74 -57.76 2.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.267 177.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.71 ' CG ' HD12 ' A' ' 34' ' ' LEU . 54.9 mtt180 -45.48 -57.03 4.41 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.614 -179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -42.14 -40.32 2.29 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.917 0.389 . . . . 0.0 111.452 -179.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.541 ' HE1' ' H ' ' A' ' 6' ' ' CYS . 49.3 mtm -79.64 -30.7 41.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.747 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.004 HD21 HD12 ' A' ' 7' ' ' LEU . 5.2 mt -82.33 -67.23 0.8 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.679 -179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.563 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -42.56 -29.49 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 120.855 0.359 . . . . 0.0 111.607 -178.432 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 t -84.9 -68.34 0.73 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.407 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -87.71 -78.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.661 ' O ' HG13 ' A' ' 52' ' ' VAL . 6.4 p 32.68 100.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.585 0.707 . . . . 0.0 112.562 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -63.69 -65.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.719 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.5 ' CG2' HG22 ' A' ' 52' ' ' VAL . 2.8 p 65.58 136.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.651 -178.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.916 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.473 ' HA ' ' CE2' ' A' ' 17' ' ' PHE . 8.6 ptm . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.972 0.415 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.741 HD12 HD21 ' A' ' 7' ' ' LEU . 6.0 mt -121.18 138.85 28.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.838 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.703 ' O ' HG23 ' A' ' 4' ' ' VAL . 30.0 Cg_endo -80.21 53.67 4.86 Favored 'Trans proline' 0 CA--C 1.513 -0.537 0 C-N-CA 123.095 2.53 . . . . 0.0 111.132 177.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.5 t 152.79 168.72 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 O-C-N 124.286 0.992 . . . . 0.0 108.41 -173.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 0.0 OUTLIER 80.3 -163.24 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 111.212 -179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.976 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -114.71 96.88 5.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.17 -179.851 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.075 HD12 HD21 ' A' ' 48' ' ' LEU . 1.1 mm? -135.62 41.81 2.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.276 178.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.437 ' HA ' HG13 ' A' ' 13' ' ' VAL . 0.2 OUTLIER -173.78 -66.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.002 -178.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 68.82 24.18 6.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.813 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.31 -18.25 9.55 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.528 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.63 101.91 26.51 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.577 0.227 . . . . 0.0 111.194 -178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HA ' ' OG ' ' A' ' 8' ' ' SER . 87.8 Cg_exo -38.82 134.46 0.91 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.836 2.358 . . . . 0.0 112.534 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.855 HG11 HD23 ' A' ' 39' ' ' LEU . 8.1 m -107.53 -25.96 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.234 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 m -48.65 -52.02 25.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.436 -179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.33 -29.28 69.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.3 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.873 ' HB3' HD23 ' A' ' 37' ' ' LEU . 11.4 m-85 -87.38 -24.61 24.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.457 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 1' ' ' MET . 3.0 m-30 -44.95 -29.57 0.85 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.864 0.364 . . . . 0.0 110.996 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -60.97 -39.58 90.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.299 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.84 -51.59 68.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.172 178.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' CZ ' HG21 ' A' ' 24' ' ' VAL . 19.2 t80 -54.8 -48.2 73.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.236 178.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 3.0 tt0 -57.25 -61.77 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.494 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -51.29 -49.13 61.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.501 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.548 ' HG2' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -61.8 -72.03 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.65 179.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.712 HG22 ' HG3' ' A' ' 30' ' ' PRO . 43.4 t -47.75 -28.02 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.383 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 21' ' ' GLN . . . -58.88 -55.6 33.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.41 ' HB3' ' OE1' ' A' ' 28' ' ' GLU . 3.5 t0 -71.61 -62.99 1.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 160.17 38.17 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.052 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 5.1 mp0 -97.57 137.63 36.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 120.862 0.363 . . . . 0.0 110.883 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -50.97 110.47 1.78 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.712 ' HG3' HG22 ' A' ' 24' ' ' VAL . 33.7 Cg_exo -57.16 -43.55 52.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.191 1.927 . . . . 0.0 111.741 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -47.01 -43.11 19.24 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.117 0.484 . . . . 0.0 110.477 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -40.12 95.41 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.508 176.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.657 HG11 ' HA ' ' A' ' 20' ' ' TYR . 59.7 t -59.41 -45.02 93.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.093 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD12 ' HG2' ' A' ' 45' ' ' ARG . 3.2 mm? -49.6 -38.67 32.6 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.424 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -62.28 -34.67 77.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.779 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' VAL . 0.8 OUTLIER -82.16 -43.1 18.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.441 178.631 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.882 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.7 OUTLIER -45.92 -46.85 16.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.646 178.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.9 50.43 1.01 Allowed Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.739 -0.664 . . . . 0.0 113.136 178.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.882 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.0 OUTLIER -129.29 78.66 1.87 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.919 0.39 . . . . 0.0 110.549 179.836 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -45.97 -78.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.477 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -46.57 118.65 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.28 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 45' ' ' ARG . 7.5 p90 -64.19 -20.47 66.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 26.3 p -48.14 -28.47 2.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 110.682 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 2.4 m -87.31 -53.26 4.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.258 178.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.887 ' HG2' HD12 ' A' ' 34' ' ' LEU . 10.9 mtp180 -47.44 -59.17 3.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.191 -179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -41.53 -34.43 0.57 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.752 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.412 ' HE1' ' HG3' ' A' ' 5' ' ' ARG . 25.9 mtm -87.41 -30.15 20.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.141 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.075 HD21 HD12 ' A' ' 7' ' ' LEU . 5.0 mt -83.55 -66.92 0.84 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.611 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.503 ' CG2' HD21 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -42.93 -31.06 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.78 -178.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.26 -73.47 0.36 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.467 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -87.2 -76.41 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.891 -178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 52' ' ' VAL . 9.7 p 36.74 98.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.464 0.649 . . . . 0.0 112.235 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.455 ' O ' HG23 ' A' ' 54' ' ' THR . 0.4 OUTLIER -47.66 101.03 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.267 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 53' ' ' GLU . 32.8 p -157.76 96.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.99 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.94 -179.894 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_